ethyl 1-(1H-benzimidazol-2-ylmethyl)-4-phenethyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-(1H-benzimidazol-2-ylmethyl)-4-phenethyl-piperidine-4-carboxylate Openeye Name: ethyl 1-(1H-benzimidazol-2-ylmethyl)-4-phenethyl-piperidine-4-carboxylate CAS Name: 1-(1H-benzimidazol-2-ylmethyl)-4-phenethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1H-benzimidazol-2-ylmethyl)-4-phenethylpiperidine-4-carboxylate Traditional Name: 1-(1H-benzimidazol-2-ylmethyl)-4-phenethyl-isonipecotic acid ethyl ester Formula: C24H29N3O2 MolecularWeight: 391.50596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=NC3=CC=CC=C3N2)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=NC3=CC=CC=C3N2)CCC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O2/c1-2-29-23(28)24(13-12-19-8-4-3-5-9-19)14-16-27(17-15-24)18-22-25-20-10-6-7-11-21(20)26-22/h3-11H,2,12-18H2,1H3,(H,25,26)