2-[(2R)-4-[(S)-(2-bromophenyl)-phenyl-methyl]-2-methyl-piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[(2R)-4-[(S)-(2-bromophenyl)-phenyl-methyl]-2-methyl-piperazin-1-yl]ethanoic acid Openeye Name: 2-[(2R)-4-[(S)-(2-bromophenyl)-phenyl-methyl]-2-methyl-piperazin-1-yl]acetic acid CAS Name: 2-[(2R)-4-[(S)-(2-bromophenyl)-phenylmethyl]-2-methyl-1-piperazinyl]acetic acid IUPAC Name: 2-[(2R)-4-[(S)-(2-bromophenyl)-phenylmethyl]-2-methylpiperazin-1-yl]acetic acid Traditional Name: 2-[(2R)-4-[(S)-(2-bromophenyl)-phenyl-methyl]-2-methyl-piperazino]acetic acid Formula: C20H23BrN2O2 MolecularWeight: 403.31282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC(=O)O)C(C2=CC=CC=C2)C3=CC=CC=C3Br

Isomeric SMILES

C[C@@H]1CN(CCN1CC(=O)O)[C@@H](C2=CC=CC=C2)C3=CC=CC=C3Br

InChI

InChI=1S/C20H23BrN2O2/c1-15-13-23(12-11-22(15)14-19(24)25)20(16-7-3-2-4-8-16)17-9-5-6-10-18(17)21/h2-10,15,20H,11-14H2,1H3,(H,24,25)/t15-,20+/m1/s1