[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-benzamido-3-phenyl-propanoate

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-benzamido-3-phenyl-propanoate Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl] 3-benzamido-3-phenyl-propanoate CAS Name: 3-benzamido-3-phenylpropanoic acid [2-(3-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl] 3-benzamido-3-phenylpropanoate Traditional Name: 3-benzamido-3-phenyl-propionic acid [2-(3-bromoanilino)-2-keto-ethyl] ester Formula: C24H21BrN2O4 MolecularWeight: 481.33854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)OCC(=O)NC2=CC(=CC=C2)Br)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)OCC(=O)NC2=CC(=CC=C2)Br)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H21BrN2O4/c25-19-12-7-13-20(14-19)26-22(28)16-31-23(29)15-21(17-8-3-1-4-9-17)27-24(30)18-10-5-2-6-11-18/h1-14,21H,15-16H2,(H,26,28)(H,27,30)