[(E)-octadec-9-enyl] 2-[(2E)-2-[4-cyano-1-[1-[(5E)-4-cyano-3-methyl-5-[[2-[(E)-octadec-9-enoxy]carbonylphenyl]hydrazinylidene]-2,6-bis(oxidanylidene)pyridin-1-yl]dodecyl]-5-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]hydrazinyl]benzoate

Systemtic Name: [(E)-octadec-9-enyl] 2-[(2E)-2-[4-cyano-1-[1-[(5E)-4-cyano-3-methyl-5-[[2-[(E)-octadec-9-enoxy]carbonylphenyl]hydrazinylidene]-2,6-bis(oxidanylidene)pyridin-1-yl]dodecyl]-5-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]hydrazinyl]benzoate Openeye Name: [(E)-octadec-9-enyl] 2-[(2E)-2-[4-cyano-1-[1-[(5E)-4-cyano-3-methyl-5-[[2-[(E)-octadec-9-enoxy]carbonylphenyl]hydrazono]-2,6-dioxo-1-pyridyl]dodecyl]-5-methyl-2,6-dioxo-3-pyridylidene]hydrazino]benzoate CAS Name: 2-[(2E)-2-[4-cyano-1-[1-[(5E)-4-cyano-3-methyl-5-[[2-[[(E)-octadec-9-enoxy]-oxomethyl]phenyl]hydrazinylidene]-2,6-dioxo-1-pyridinyl]dodecyl]-5-methyl-2,6-dioxo-3-pyridinylidene]hydrazinyl]benzoic acid [(E)-octadec-9-enyl] ester IUPAC Name: [(E)-octadec-9-enyl] 2-[(2E)-2-[4-cyano-1-[1-[(5E)-4-cyano-3-methyl-5-[[2-[(E)-octadec-9-enoxy]carbonylphenyl]hydrazinylidene]-2,6-dioxopyridin-1-yl]dodecyl]-5-methyl-2,6-dioxopyridin-3-ylidene]hydrazinyl]benzoate Traditional Name: 2-[(N'E)-N'-[4-cyano-1-[1-[(5E)-4-cyano-2,6-diketo-3-methyl-5-[[2-[(E)-octadec-9-enoxy]carbonylphenyl]hydrazono]-1-pyridyl]dodecyl]-2,6-diketo-5-methyl-3-pyridylidene]hydrazino]benzoic acid [(E)-octadec-9-enyl] ester Formula: C76H110N8O8 MolecularWeight: 1263.7354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(N1C(=O)C(=C(C(=NNC2=CC=CC=C2C(=O)OCCCCCCCCC=CCCCCCCCC)C1=O)C#N)C)N3C(=O)C(=C(C(=NNC4=CC=CC=C4C(=O)OCCCCCCCCC=CCCCCCCCC)C3=O)C#N)C

Isomeric SMILES

CCCCCCCCCCCC(N1C(=O)/C(=N/NC2=CC=CC=C2C(=O)OCCCCCCCC/C=C/CCCCCCCC)/C(=C(C1=O)C)C#N)N3C(=O)/C(=N/NC4=CC=CC=C4C(=O)OCCCCCCCC/C=C/CCCCCCCC)/C(=C(C3=O)C)C#N

InChI

InChI=1S/C76H110N8O8/c1-6-9-12-15-18-21-23-25-27-29-31-33-36-39-42-49-56-91-75(89)62-51-45-47-53-66(62)79-81-69-64(58-77)60(4)71(85)83(73(69)87)68(55-44-41-38-35-20-17-14-11-8-3)84-72(86)61(5)65(59-78)70(74(84)88)82-80-67-54-48-46-52-63(67)76(90)92-57-50-43-40-37-34-32-30-28-26-24-22-19-16-13-10-7-2/h25-28,45-48,51-54,68,79-80H,6-24,29-44,49-50,55-57H2,1-5H3/b27-25+,28-26+,81-69+,82-70+