1-[(3-bromophenyl)-naphthalen-2-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-naphthalen-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-(2-naphthyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-bromophenyl)-(2-naphthalenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-naphthalen-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-(2-naphthyl)methyl]pipecolinic acid Formula: C23H22BrNO2 MolecularWeight: 424.33028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)Br)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)Br)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H22BrNO2/c24-20-9-5-8-18(15-20)22(25-13-4-3-10-21(25)23(26)27)19-12-11-16-6-1-2-7-17(16)14-19/h1-2,5-9,11-12,14-15,21-22H,3-4,10,13H2,(H,26,27)