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

Systemtic Name: 4-[[4-[(E)-2-cyano-3-[(3-methoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate Openeye Name: 4-[[4-[(E)-2-cyano-3-(3-methoxyanilino)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-2-cyano-3-(3-methoxyanilino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]methyl]benzoate IUPAC Name: 4-[[4-[(E)-2-cyano-3-(3-methoxyanilino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-2-cyano-3-keto-3-(m-anisidino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate Formula: C26H21N2O6- MolecularWeight: 457.45474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)[O-])OC)C#N

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)[O-])OC)/C#N

InChI

InChI=1S/C26H22N2O6/c1-32-22-5-3-4-21(14-22)28-25(29)20(15-27)12-18-8-11-23(24(13-18)33-2)34-16-17-6-9-19(10-7-17)26(30)31/h3-14H,16H2,1-2H3,(H,28,29)(H,30,31)/p-1/b20-12+