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

Systemtic Name: methyl 4-[[4-[2-cyano-3-[(4-ethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[2-cyano-3-(4-ethylanilino)-3-oxo-prop-1-enyl]phenoxy]methyl]benzoate CAS Name: 4-[[4-[2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoate Traditional Name: 4-[[4-[2-cyano-3-(4-ethylanilino)-3-keto-prop-1-enyl]phenoxy]methyl]benzoic acid methyl ester Formula: C27H24N2O4 MolecularWeight: 440.49046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC)C#N

InChI

InChI=1S/C27H24N2O4/c1-3-19-6-12-24(13-7-19)29-26(30)23(17-28)16-20-8-14-25(15-9-20)33-18-21-4-10-22(11-5-21)27(31)32-2/h4-16H,3,18H2,1-2H3,(H,29,30)