(3R)-3-[(4-bromophenyl)methyl]-4-oxidanylidene-4-phenylazanyl-butanoate

Systemtic Name: (3R)-3-[(4-bromophenyl)methyl]-4-oxidanylidene-4-phenylazanyl-butanoate Openeye Name: (3R)-4-anilino-3-[(4-bromophenyl)methyl]-4-oxo-butanoate CAS Name: (3R)-4-anilino-3-[(4-bromophenyl)methyl]-4-oxobutanoate IUPAC Name: (3R)-4-anilino-3-[(4-bromophenyl)methyl]-4-oxobutanoate Traditional Name: (3R)-4-anilino-3-(4-bromobenzyl)-4-keto-butyrate Formula: C17H15BrNO3- MolecularWeight: 361.2099

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(CC2=CC=C(C=C2)Br)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)[C@H](CC2=CC=C(C=C2)Br)CC(=O)[O-]

InChI

InChI=1S/C17H16BrNO3/c18-14-8-6-12(7-9-14)10-13(11-16(20)21)17(22)19-15-4-2-1-3-5-15/h1-9,13H,10-11H2,(H,19,22)(H,20,21)/p-1/t13-/m1/s1