methyl 5-[bis[2-[3-[3-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecanoyl-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecyl]amino]propanoyl-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecyl]amino]propanoylamino]ethyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[bis[2-[3-[3-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecanoyl-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecyl]amino]propanoyl-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecyl]amino]propanoylamino]ethyl]amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[bis[2-[3-[3-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecanoyl(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)amino]propanoyl-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)amino]propanoylamino]ethyl]amino]-5-oxo-pentanoate CAS Name: 5-[bis[2-[[3-[[3-[(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-1-oxoundecyl)-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)amino]-1-oxopropyl]-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)amino]-1-oxopropyl]amino]ethyl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[bis[2-[3-[3-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecanoyl(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)amino]propanoyl-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)amino]propanoylamino]ethyl]amino]-5-oxopentanoate Traditional Name: 5-[bis[2-[3-[3-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecanoyl(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)amino]propanoyl-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)amino]propanoylamino]ethyl]amino]-5-keto-valeric acid methyl ester Formula: C88H67F102N7O9 MolecularWeight: 3304.352206

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)N(CCNC(=O)CCN(CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)CCN(CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCNC(=O)CCN(CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)CCN(CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

COC(=O)CCCC(=O)N(CCNC(=O)CCN(CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)CCN(CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCNC(=O)CCN(CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)CCN(CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C88H67F102N7O9/c1-206-40(205)8-2-7-35(200)197(31-21-191-33(198)11-27-193(23-3-15-41(89,90)47(101,102)53(113,114)59(125,126)65(137,138)71(149,150)77(161,162)83(173,174)175)38(203)13-29-195(25-5-17-43(93,94)49(105,106)55(117,118)61(129,130)67(141,142)73(153,154)79(165,166)85(179,180)181)36(201)9-19-45(97,98)51(109,110)57(121,122)63(133,134)69(145,146)75(157,158)81(169,170)87(185,186)187)32-22-192-34(199)12-28-194(24-4-16-42(91,92)48(103,104)54(115,116)60(127,128)66(139,140)72(151,152)78(163,164)84(176,177)178)39(204)14-30-196(26-6-18-44(95,96)50(107,108)56(119,120)62(131,132)68(143,144)74(155,156)80(167,168)86(182,183)184)37(202)10-20-46(99,100)52(111,112)58(123,124)64(135,136)70(147,148)76(159,160)82(171,172)88(188,189)190/h2-32H2,1H3,(H,191,198)(H,192,199)