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

Systemtic Name: 2-[3-cyano-4-(4-methylpiperidin-1-yl)phenyl]pyridine-4-carboxylic acid Openeye Name: 2-[3-cyano-4-(4-methyl-1-piperidyl)phenyl]pyridine-4-carboxylic acid CAS Name: 2-[3-cyano-4-(4-methyl-1-piperidinyl)phenyl]-4-pyridinecarboxylic acid IUPAC Name: 2-[3-cyano-4-(4-methylpiperidin-1-yl)phenyl]pyridine-4-carboxylic acid Traditional Name: 2-[3-cyano-4-(4-methylpiperidino)phenyl]isonicotinic acid Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C3=NC=CC(=C3)C(=O)O)C#N

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C3=NC=CC(=C3)C(=O)O)C#N

InChI

InChI=1S/C19H19N3O2/c1-13-5-8-22(9-6-13)18-3-2-14(10-16(18)12-20)17-11-15(19(23)24)4-7-21-17/h2-4,7,10-11,13H,5-6,8-9H2,1H3,(H,23,24)