2-[[5-[2-[ethyl-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecakis(fluoranyl)heptylsulfonyl]amino]ethoxycarbonylamino]-2-methyl-phenyl]carbamoyloxy]propyl 2-methylprop-2-enoate

Systemtic Name: 2-[[5-[2-[ethyl-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecakis(fluoranyl)heptylsulfonyl]amino]ethoxycarbonylamino]-2-methyl-phenyl]carbamoyloxy]propyl 2-methylprop-2-enoate Openeye Name: 2-[[5-[2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsulfonyl)amino]ethoxycarbonylamino]-2-methyl-phenyl]carbamoyloxy]propyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 2-[[5-[[2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsulfonyl)amino]ethoxy-oxomethyl]amino]-2-methylanilino]-oxomethoxy]propyl ester IUPAC Name: 2-[[5-[2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsulfonyl)amino]ethoxycarbonylamino]-2-methylphenyl]carbamoyloxy]propyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 2-[[5-[2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsulfonyl)amino]ethoxycarbonylamino]-2-methyl-phenyl]carbamoyloxy]propyl ester Formula: C27H28F15N3O8S MolecularWeight: 839.567568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCOC(=O)NC1=CC(=C(C=C1)C)NC(=O)OC(C)COC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

CCN(CCOC(=O)NC1=CC(=C(C=C1)C)NC(=O)OC(C)COC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C27H28F15N3O8S/c1-6-45(54(49,50)27(41,42)25(36,37)23(32,33)21(28,29)22(30,31)24(34,35)26(38,39)40)9-10-51-19(47)43-16-8-7-14(4)17(11-16)44-20(48)53-15(5)12-52-18(46)13(2)3/h7-8,11,15H,2,6,9-10,12H2,1,3-5H3,(H,43,47)(H,44,48)