ethyl 1-(1H-imidazol-2-ylmethyl)-3-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(1H-imidazol-2-ylmethyl)-3-(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl 3-benzyl-1-(1H-imidazol-2-ylmethyl)piperidine-3-carboxylate CAS Name: 1-(1H-imidazol-2-ylmethyl)-3-(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzyl-1-(1H-imidazol-2-ylmethyl)piperidine-3-carboxylate Traditional Name: 3-benzyl-1-(1H-imidazol-2-ylmethyl)nipecotic acid ethyl ester Formula: C19H25N3O2 MolecularWeight: 327.4207

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2=NC=CN2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)CC2=NC=CN2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O2/c1-2-24-18(23)19(13-16-7-4-3-5-8-16)9-6-12-22(15-19)14-17-20-10-11-21-17/h3-5,7-8,10-11H,2,6,9,12-15H2,1H3,(H,20,21)