phenacyl 4-[(3,4-dimethylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: phenacyl 4-[(3,4-dimethylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: phenacyl 4-(3,4-dimethylanilino)-4-oxo-butanoate CAS Name: 4-(3,4-dimethylanilino)-4-oxobutanoic acid phenacyl ester IUPAC Name: phenacyl 4-(3,4-dimethylanilino)-4-oxobutanoate Traditional Name: 4-(3,4-dimethylanilino)-4-keto-butyric acid phenacyl ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC(=O)OCC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC(=O)OCC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C20H21NO4/c1-14-8-9-17(12-15(14)2)21-19(23)10-11-20(24)25-13-18(22)16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,21,23)