methyl 4-[[3-[2-cyano-3-[(4-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[3-[2-cyano-3-[(4-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[3-[2-cyano-3-(4-ethoxyanilino)-3-oxo-prop-1-enyl]phenoxy]methyl]benzoate CAS Name: 4-[[3-[2-cyano-3-(4-ethoxyanilino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-[2-cyano-3-(4-ethoxyanilino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoate Traditional Name: 4-[[3-[2-cyano-3-keto-3-(p-phenetidino)prop-1-enyl]phenoxy]methyl]benzoic acid methyl ester Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=CC=C2)OCC3=CC=C(C=C3)C(=O)OC)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=CC=C2)OCC3=CC=C(C=C3)C(=O)OC)C#N

InChI

InChI=1S/C27H24N2O5/c1-3-33-24-13-11-23(12-14-24)29-26(30)22(17-28)15-20-5-4-6-25(16-20)34-18-19-7-9-21(10-8-19)27(31)32-2/h4-16H,3,18H2,1-2H3,(H,29,30)