[5-[2-cyano-3-[(2,6-dimethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-methoxybenzoate

Systemtic Name: [5-[2-cyano-3-[(2,6-dimethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-methoxybenzoate Openeye Name: [5-[2-cyano-3-(2,6-dimethylanilino)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [5-[2-cyano-3-(2,6-dimethylanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [5-[2-cyano-3-(2,6-dimethylanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [5-[2-cyano-3-(2,6-dimethylanilino)-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(=CC2=CC(=C(C=C2)OC)OC(=O)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C(=CC2=CC(=C(C=C2)OC)OC(=O)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C27H24N2O5/c1-17-6-5-7-18(2)25(17)29-26(30)21(16-28)14-19-8-13-23(33-4)24(15-19)34-27(31)20-9-11-22(32-3)12-10-20/h5-15H,1-4H3,(H,29,30)