[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-phenylbutanoate

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-phenylbutanoate Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl] 3-phenylbutanoate CAS Name: 3-phenylbutanoic acid [2-(3-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl] 3-phenylbutanoate Traditional Name: 3-phenylbutyric acid [2-(3-bromoanilino)-2-keto-ethyl] ester Formula: C18H18BrNO3 MolecularWeight: 376.24442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO3/c1-13(14-6-3-2-4-7-14)10-18(22)23-12-17(21)20-16-9-5-8-15(19)11-16/h2-9,11,13H,10,12H2,1H3,(H,20,21)