2-[[(4-fluoranyl-2-methyl-phenyl)amino]methyl]-6-piperidin-1-yl-pyridine-4-carboxylic acid

Systemtic Name: 2-[[(4-fluoranyl-2-methyl-phenyl)amino]methyl]-6-piperidin-1-yl-pyridine-4-carboxylic acid Openeye Name: 2-[(4-fluoro-2-methyl-anilino)methyl]-6-(1-piperidyl)pyridine-4-carboxylic acid CAS Name: 2-[(4-fluoro-2-methylanilino)methyl]-6-(1-piperidinyl)-4-pyridinecarboxylic acid IUPAC Name: 2-[(4-fluoro-2-methylanilino)methyl]-6-piperidin-1-ylpyridine-4-carboxylic acid Traditional Name: 2-[(4-fluoro-2-methyl-anilino)methyl]-6-piperidino-isonicotinic acid Formula: C19H22FN3O2 MolecularWeight: 343.395283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NCC2=NC(=CC(=C2)C(=O)O)N3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)F)NCC2=NC(=CC(=C2)C(=O)O)N3CCCCC3

InChI

InChI=1S/C19H22FN3O2/c1-13-9-15(20)5-6-17(13)21-12-16-10-14(19(24)25)11-18(22-16)23-7-3-2-4-8-23/h5-6,9-11,21H,2-4,7-8,12H2,1H3,(H,24,25)