1-[(3-bromophenyl)-naphthalen-1-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-naphthalen-1-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-(1-naphthyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-bromophenyl)-(1-naphthalenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-naphthalen-1-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-(1-naphthyl)methyl]isonipecotic acid Formula: C23H22BrNO2 MolecularWeight: 424.33028

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC(=CC=C2)Br)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC(=CC=C2)Br)C3=CC=CC4=CC=CC=C43

InChI

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