[2,5-bis(oxidanylidene)pyrrolidin-1-yl] 2-[[[3',6'-bis(oxidanyl)-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-yl]carbonylamino]methyl]-5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecakis(fluoranyl)dodecanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] 2-[[[3',6'-bis(oxidanyl)-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-yl]carbonylamino]methyl]-5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecakis(fluoranyl)dodecanoate Openeye Name: (2,5-dioxopyrrolidin-1-yl) 2-[[(3',6'-dihydroxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-carbonyl)amino]methyl]-5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluoro-dodecanoate CAS Name: 2-[[[(3',6'-dihydroxy-3-oxo-5-spiro[isobenzofuran-1,9'-xanthene]yl)-oxomethyl]amino]methyl]-5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecanoic acid (2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 2-[[(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-carbonyl)amino]methyl]-5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecanoate Traditional Name: 2-[[(3',6'-dihydroxy-3-keto-spiro[phthalan-1,9'-xanthene]-5-carbonyl)amino]methyl]-5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluoro-lauric acid succinimido ester Formula: C38H23F17N2O10 MolecularWeight: 990.569474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)OC(=O)C(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)CNC(=O)C2=CC3=C(C=C2)C4(C5=C(C=C(C=C5)O)OC6=C4C=CC(=C6)O)OC3=O

Isomeric SMILES

C1CC(=O)N(C1=O)OC(=O)C(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)CNC(=O)C2=CC3=C(C=C2)C4(C5=C(C=C(C=C5)O)OC6=C4C=CC(=C6)O)OC3=O

InChI

InChI=1S/C38H23F17N2O10/c39-30(40,32(41,42)33(43,44)34(45,46)35(47,48)36(49,50)37(51,52)38(53,54)55)10-9-16(28(63)67-57-25(60)7-8-26(57)61)14-56-27(62)15-1-4-20-19(11-15)29(64)66-31(20)21-5-2-17(58)12-23(21)65-24-13-18(59)3-6-22(24)31/h1-6,11-13,16,58-59H,7-10,14H2,(H,56,62)