2-[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]ethyl 4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: 2-[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]ethyl 4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: 2-[4-[(2-benzyloxyphenyl)methyl]piperazin-1-yl]ethyl 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylic acid 2-[4-[(2-phenylmethoxyphenyl)methyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]ethyl 4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 4-(2-keto-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridine-1-carboxylic acid 2-[4-(2-benzoxybenzyl)piperazino]ethyl ester Formula: C33H37N5O4 MolecularWeight: 567.67798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1N2C3=CC=CC=C3NC2=O)C(=O)OCCN4CCN(CC4)CC5=CC=CC=C5OCC6=CC=CC=C6

Isomeric SMILES

C1CN(CC=C1N2C3=CC=CC=C3NC2=O)C(=O)OCCN4CCN(CC4)CC5=CC=CC=C5OCC6=CC=CC=C6

InChI

InChI=1S/C33H37N5O4/c39-32-34-29-11-5-6-12-30(29)38(32)28-14-16-37(17-15-28)33(40)41-23-22-35-18-20-36(21-19-35)24-27-10-4-7-13-31(27)42-25-26-8-2-1-3-9-26/h1-14H,15-25H2,(H,34,39)