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

Systemtic Name: (2S)-2-[(3-bromophenyl)methyl-(phenylcarbonyl)amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[benzoyl-[(3-bromophenyl)methyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[benzoyl-[(3-bromophenyl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[benzoyl-[(3-bromophenyl)methyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[benzoyl-(3-bromobenzyl)amino]-3-phenyl-propionic acid Formula: C23H20BrNO3 MolecularWeight: 438.3138

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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

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

InChI

InChI=1S/C23H20BrNO3/c24-20-13-7-10-18(14-20)16-25(22(26)19-11-5-2-6-12-19)21(23(27)28)15-17-8-3-1-4-9-17/h1-14,21H,15-16H2,(H,27,28)/t21-/m0/s1