[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-methyl-3-(propanoylamino)benzoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-methyl-3-(propanoylamino)benzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-methyl-3-(propanoylamino)benzoate CAS Name: 4-methyl-3-(1-oxopropylamino)benzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-methyl-3-(propanoylamino)benzoate Traditional Name: 4-methyl-3-propionamido-benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C19H18BrNO4 MolecularWeight: 404.25452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C19H18BrNO4/c1-3-18(23)21-16-10-14(5-4-12(16)2)19(24)25-11-17(22)13-6-8-15(20)9-7-13/h4-10H,3,11H2,1-2H3,(H,21,23)