[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 2-bromanyl-5-methoxy-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 2-bromanyl-5-methoxy-benzoate Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl] 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid [(2S)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl] 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid [(1S)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C17H16BrNO4 MolecularWeight: 378.21724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrNO4/c1-11(16(20)19-12-6-4-3-5-7-12)23-17(21)14-10-13(22-2)8-9-15(14)18/h3-11H,1-2H3,(H,19,20)/t11-/m0/s1