[4-[1-oxidanyl-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]-2-pyridin-3-ylcarbonyloxy-phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[1-oxidanyl-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]-2-pyridin-3-ylcarbonyloxy-phenyl] pyridine-3-carboxylate Openeye Name: [4-[1-hydroxy-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]ethyl]-2-(pyridine-3-carbonyloxy)phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[1-hydroxy-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]ethyl]-2-[oxo(3-pyridinyl)methoxy]phenyl] ester IUPAC Name: [4-[1-hydroxy-2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]-2-(pyridine-3-carbonyloxy)phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[1-hydroxy-2-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]ethyl]-2-nicotinoyloxy-phenyl] ester Formula: C32H29N5O6 MolecularWeight: 579.60256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC(C4=CC(=C(C=C4)OC(=O)C5=CN=CC=C5)OC(=O)C6=CN=CC=C6)O

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC(C4=CC(=C(C=C4)OC(=O)C5=CN=CC=C5)OC(=O)C6=CN=CC=C6)O

InChI

InChI=1S/C32H29N5O6/c38-27(20-36-15-11-24(12-16-36)37-26-8-2-1-7-25(26)35-32(37)41)21-9-10-28(42-30(39)22-5-3-13-33-18-22)29(17-21)43-31(40)23-6-4-14-34-19-23/h1-10,13-14,17-19,24,27,38H,11-12,15-16,20H2,(H,35,41)