[1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-phenylbutanoate

Systemtic Name: [1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-phenylbutanoate Openeye Name: [2-(4-bromoanilino)-1-methyl-2-oxo-ethyl] 3-phenylbutanoate CAS Name: 3-phenylbutanoic acid [1-(4-bromoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromoanilino)-1-oxopropan-2-yl] 3-phenylbutanoate Traditional Name: 3-phenylbutyric acid [2-(4-bromoanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H20BrNO3 MolecularWeight: 390.271

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC(C)C(=O)NC1=CC=C(C=C1)Br)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)OC(C)C(=O)NC1=CC=C(C=C1)Br)C2=CC=CC=C2

InChI

InChI=1S/C19H20BrNO3/c1-13(15-6-4-3-5-7-15)12-18(22)24-14(2)19(23)21-17-10-8-16(20)9-11-17/h3-11,13-14H,12H2,1-2H3,(H,21,23)