[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate

Systemtic Name: [2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate Openeye Name: [2-(4-bromoanilino)-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [2-(4-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromoanilino)-2-oxoethyl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [2-(4-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=C(C=C1)Br)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CC(=O)OCC(=O)NC1=CC=C(C=C1)Br)C2=CC=CC=C2

InChI

InChI=1S/C18H18BrNO3/c1-13(14-5-3-2-4-6-14)11-18(22)23-12-17(21)20-16-9-7-15(19)8-10-16/h2-10,13H,11-12H2,1H3,(H,20,21)/t13-/m1/s1