(2S)-2-[(3-bromophenyl)methyl-(3-chlorophenyl)carbonyl-amino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[(3-bromophenyl)methyl-(3-chlorophenyl)carbonyl-amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[(3-bromophenyl)methyl-(3-chlorobenzoyl)amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[(3-bromophenyl)methyl-[(3-chlorophenyl)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[(3-bromophenyl)methyl-(3-chlorobenzoyl)amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[(3-bromobenzyl)-(3-chlorobenzoyl)amino]-3-phenyl-propionic acid Formula: C23H19BrClNO3 MolecularWeight: 472.75886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N(CC2=CC(=CC=C2)Br)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)N(CC2=CC(=CC=C2)Br)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H19BrClNO3/c24-19-10-4-8-17(12-19)15-26(22(27)18-9-5-11-20(25)14-18)21(23(28)29)13-16-6-2-1-3-7-16/h1-12,14,21H,13,15H2,(H,28,29)/t21-/m0/s1