[(Z)-[1-(4-decoxyphenyl)carbonyl-2-oxidanylidene-indol-3-ylidene]amino] 4-decoxybenzoate

Systemtic Name: [(Z)-[1-(4-decoxyphenyl)carbonyl-2-oxidanylidene-indol-3-ylidene]amino] 4-decoxybenzoate Openeye Name: [(Z)-[1-(4-decoxybenzoyl)-2-oxo-indolin-3-ylidene]amino] 4-decoxybenzoate CAS Name: 4-decoxybenzoic acid [(Z)-[1-[(4-decoxyphenyl)-oxomethyl]-2-oxo-3-indolylidene]amino] ester IUPAC Name: [(Z)-[1-(4-decoxybenzoyl)-2-oxoindol-3-ylidene]amino] 4-decoxybenzoate Traditional Name: 4-decoxybenzoic acid [(Z)-[1-(4-decoxybenzoyl)-2-keto-indolin-3-ylidene]amino] ester Formula: C42H54N2O6 MolecularWeight: 682.88796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3C(=NOC(=O)C4=CC=C(C=C4)OCCCCCCCCCC)C2=O

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3/C(=N/OC(=O)C4=CC=C(C=C4)OCCCCCCCCCC)/C2=O

InChI

InChI=1S/C42H54N2O6/c1-3-5-7-9-11-13-15-19-31-48-35-27-23-33(24-28-35)40(45)44-38-22-18-17-21-37(38)39(41(44)46)43-50-42(47)34-25-29-36(30-26-34)49-32-20-16-14-12-10-8-6-4-2/h17-18,21-30H,3-16,19-20,31-32H2,1-2H3/b43-39-