2-[3-cyano-4-(4-fluoranylpiperidin-1-yl)phenyl]pyridine-4-carboxylic acid

Systemtic Name: 2-[3-cyano-4-(4-fluoranylpiperidin-1-yl)phenyl]pyridine-4-carboxylic acid Openeye Name: 2-[3-cyano-4-(4-fluoro-1-piperidyl)phenyl]pyridine-4-carboxylic acid CAS Name: 2-[3-cyano-4-(4-fluoro-1-piperidinyl)phenyl]-4-pyridinecarboxylic acid IUPAC Name: 2-[3-cyano-4-(4-fluoropiperidin-1-yl)phenyl]pyridine-4-carboxylic acid Traditional Name: 2-[3-cyano-4-(4-fluoropiperidino)phenyl]isonicotinic acid Formula: C18H16FN3O2 MolecularWeight: 325.336943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1F)C2=C(C=C(C=C2)C3=NC=CC(=C3)C(=O)O)C#N

Isomeric SMILES

C1CN(CCC1F)C2=C(C=C(C=C2)C3=NC=CC(=C3)C(=O)O)C#N

InChI

InChI=1S/C18H16FN3O2/c19-15-4-7-22(8-5-15)17-2-1-12(9-14(17)11-20)16-10-13(18(23)24)3-6-21-16/h1-3,6,9-10,15H,4-5,7-8H2,(H,23,24)