1-[(4-bromophenyl)-naphthalen-2-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-bromophenyl)-naphthalen-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-bromophenyl)-(2-naphthyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-bromophenyl)-(2-naphthalenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-bromophenyl)-naphthalen-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-bromophenyl)-(2-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=C(C=C2)Br)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)Br)C3=CC4=CC=CC=C4C=C3

InChI

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