(5-methyl-2-propan-2-yl-cyclohexyl) 2-[(2E)-2-[4-cyano-1-[10-[8-[(5E)-4-cyano-3-methyl-5-[[2-(5-methyl-2-propan-2-yl-cyclohexyl)oxycarbonylphenyl]hydrazinylidene]-2,6-bis(oxidanylidene)pyridin-1-yl]octyl]-9-nonyl-nonadecyl]-5-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]hydrazinyl]benzoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-[(2E)-2-[4-cyano-1-[10-[8-[(5E)-4-cyano-3-methyl-5-[[2-(5-methyl-2-propan-2-yl-cyclohexyl)oxycarbonylphenyl]hydrazinylidene]-2,6-bis(oxidanylidene)pyridin-1-yl]octyl]-9-nonyl-nonadecyl]-5-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]hydrazinyl]benzoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-[(2E)-2-[4-cyano-1-[10-[8-[(3E)-4-cyano-3-[[2-(2-isopropyl-5-methyl-cyclohexoxy)carbonylphenyl]hydrazono]-5-methyl-2,6-dioxo-1-pyridyl]octyl]-9-nonyl-nonadecyl]-5-methyl-2,6-dioxo-3-pyridylidene]hydrazino]benzoate CAS Name: 2-[(2E)-2-[4-cyano-1-[10-[8-[(5E)-4-cyano-3-methyl-5-[[2-[(5-methyl-2-propan-2-ylcyclohexyl)oxy-oxomethyl]phenyl]hydrazinylidene]-2,6-dioxo-1-pyridinyl]octyl]-9-nonylnonadecyl]-5-methyl-2,6-dioxo-3-pyridinylidene]hydrazinyl]benzoic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-[(2E)-2-[4-cyano-1-[10-[8-[(5E)-4-cyano-3-methyl-5-[[2-(5-methyl-2-propan-2-ylcyclohexyl)oxycarbonylphenyl]hydrazinylidene]-2,6-dioxopyridin-1-yl]octyl]-9-nonylnonadecyl]-5-methyl-2,6-dioxopyridin-3-ylidene]hydrazinyl]benzoate Traditional Name: 2-[(N'E)-N'-[4-cyano-1-[10-[8-[(3E)-4-cyano-3-[[2-(2-isopropyl-5-methyl-cyclohexoxy)carbonylphenyl]hydrazono]-2,6-diketo-5-methyl-1-pyridyl]octyl]-9-nonyl-nonadecyl]-2,6-diketo-5-methyl-3-pyridylidene]hydrazino]benzoic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C84H126N8O8 MolecularWeight: 1375.94804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCCCN1C(=O)C(=C(C(=NNC2=CC=CC=C2C(=O)OC3CC(CCC3C(C)C)C)C1=O)C#N)C)C(CCCCCCCCC)CCCCCCCCN4C(=O)C(=C(C(=NNC5=CC=CC=C5C(=O)OC6CC(CCC6C(C)C)C)C4=O)C#N)C

Isomeric SMILES

CCCCCCCCCC(C(CCCCCCCCN1C(=O)/C(=N/NC2=CC=CC=C2C(=O)OC3C(CCC(C3)C)C(C)C)/C(=C(C1=O)C)C#N)CCCCCCCCC)CCCCCCCCN4C(=O)/C(=N/NC5=CC=CC=C5C(=O)OC6C(CCC(C6)C)C(C)C)/C(=C(C4=O)C)C#N

InChI

InChI=1S/C84H126N8O8/c1-11-13-15-17-19-25-31-41-65(43-33-27-21-23-29-39-53-91-79(93)63(9)71(57-85)77(81(91)95)89-87-73-47-37-35-45-69(73)83(97)99-75-55-61(7)49-51-67(75)59(3)4)66(42-32-26-20-18-16-14-12-2)44-34-28-22-24-30-40-54-92-80(94)64(10)72(58-86)78(82(92)96)90-88-74-48-38-36-46-70(74)84(98)100-76-56-62(8)50-52-68(76)60(5)6/h35-38,45-48,59-62,65-68,75-76,87-88H,11-34,39-44,49-56H2,1-10H3/b89-77+,90-78+