methyl 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]pyridine-3-carboxylate

Systemtic Name: methyl 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]pyridine-3-carboxylate Openeye Name: methyl 2-[4-(1H-benzimidazol-2-yl)-1-piperidyl]pyridine-3-carboxylate CAS Name: 2-[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]pyridine-3-carboxylate Traditional Name: 2-[4-(1H-benzimidazol-2-yl)piperidino]nicotinic acid methyl ester Formula: C19H20N4O2 MolecularWeight: 336.3877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=CC=C1)N2CCC(CC2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

COC(=O)C1=C(N=CC=C1)N2CCC(CC2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H20N4O2/c1-25-19(24)14-5-4-10-20-18(14)23-11-8-13(9-12-23)17-21-15-6-2-3-7-16(15)22-17/h2-7,10,13H,8-9,11-12H2,1H3,(H,21,22)