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

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

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

Canonical SMILES:

C1CC(CN(C1)C(C2=CC(=CC=C2)Br)C3=CC=CC4=CC=CC=C43)C(=O)O


Isomeric SMILES

C1CC(CN(C1)C(C2=CC(=CC=C2)Br)C3=CC=CC4=CC=CC=C43)C(=O)O


InChI

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


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