methyl 2-[4-[(Z)-2-cyano-3-[(3-methylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[(Z)-2-cyano-3-[(3-methylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoate Openeye Name: methyl 2-[4-[(Z)-2-cyano-3-(3-methylanilino)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(Z)-2-cyano-3-(3-methylanilino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(Z)-2-cyano-3-(3-methylanilino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(Z)-2-cyano-3-keto-3-(m-toluidino)prop-1-enyl]-2-methoxy-phenoxy]acetic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)/C(=C\C2=CC(=C(C=C2)OCC(=O)OC)OC)/C#N

InChI

InChI=1S/C21H20N2O5/c1-14-5-4-6-17(9-14)23-21(25)16(12-22)10-15-7-8-18(19(11-15)26-2)28-13-20(24)27-3/h4-11H,13H2,1-3H3,(H,23,25)/b16-10-