methyl (Z)-3-[(3,5-dimethylphenyl)amino]-4-oxidanylidene-4-[(phenylmethyl)amino]but-2-enoate

Systemtic Name: methyl (Z)-3-[(3,5-dimethylphenyl)amino]-4-oxidanylidene-4-[(phenylmethyl)amino]but-2-enoate Openeye Name: methyl (Z)-4-(benzylamino)-3-(3,5-dimethylanilino)-4-oxo-but-2-enoate CAS Name: (Z)-3-(3,5-dimethylanilino)-4-oxo-4-[(phenylmethyl)amino]-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-4-(benzylamino)-3-(3,5-dimethylanilino)-4-oxobut-2-enoate Traditional Name: (Z)-4-(benzylamino)-3-(3,5-dimethylanilino)-4-keto-but-2-enoic acid methyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=CC(=O)OC)C(=O)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)N/C(=C\C(=O)OC)/C(=O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C20H22N2O3/c1-14-9-15(2)11-17(10-14)22-18(12-19(23)25-3)20(24)21-13-16-7-5-4-6-8-16/h4-12,22H,13H2,1-3H3,(H,21,24)/b18-12-