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

Systemtic Name: (2S)-2-[(2-bromophenyl)methyl-methyl-amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[(2-bromophenyl)methyl-methyl-amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[(2-bromophenyl)methyl-methylamino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[(2-bromophenyl)methyl-methylamino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[(2-bromobenzyl)-methyl-amino]-3-phenyl-propionic acid Formula: C17H18BrNO2 MolecularWeight: 348.23432

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)C(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN(CC1=CC=CC=C1Br)[C@@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H18BrNO2/c1-19(12-14-9-5-6-10-15(14)18)16(17(20)21)11-13-7-3-2-4-8-13/h2-10,16H,11-12H2,1H3,(H,20,21)/t16-/m0/s1