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1-[(3-fluorophenyl)-quinolin-2-yl-methyl]piperidine-3-carboxylic acid

1-[(3-fluorophenyl)-quinolin-2-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name:1-[(3-fluorophenyl)-quinolin-2-yl-methyl]piperidine-3-carboxylic acid
Openeye Name:1-[(3-fluorophenyl)-(2-quinolyl)methyl]piperidine-3-carboxylic acid
CAS Name:1-[(3-fluorophenyl)-(2-quinolinyl)methyl]-3-piperidinecarboxylic acid
IUPAC Name:1-[(3-fluorophenyl)-quinolin-2-ylmethyl]piperidine-3-carboxylic acid
Traditional Name:1-[(3-fluorophenyl)-(2-quinolyl)methyl]nipecotic acid
Formula: C22H21FN2O2
MolecularWeight: 364.412743
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC(=CC=C2)F)C3=NC4=CC=CC=C4C=C3)C(=O)O


Isomeric SMILES

C1CC(CN(C1)C(C2=CC(=CC=C2)F)C3=NC4=CC=CC=C4C=C3)C(=O)O


InChI

InChI=1S/C22H21FN2O2/c23-18-8-3-6-16(13-18)21(25-12-4-7-17(14-25)22(26)27)20-11-10-15-5-1-2-9-19(15)24-20/h1-3,5-6,8-11,13,17,21H,4,7,12,14H2,(H,26,27)


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