[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-(3,4-dimethylanilino)-4-oxo-butanoate CAS Name: 4-(3,4-dimethylanilino)-4-oxobutanoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-(3,4-dimethylanilino)-4-oxobutanoate Traditional Name: 4-(3,4-dimethylanilino)-4-keto-butyric acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C20H20BrNO4 MolecularWeight: 418.2811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrNO4/c1-13-3-8-17(11-14(13)2)22-19(24)9-10-20(25)26-12-18(23)15-4-6-16(21)7-5-15/h3-8,11H,9-10,12H2,1-2H3,(H,22,24)