ethyl 3-[(3-chlorophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(3-chlorophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)piperidine-3-carboxylate Openeye Name: ethyl 3-[(3-chlorophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)piperidine-3-carboxylate CAS Name: 3-[(3-chlorophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-chlorophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)piperidine-3-carboxylate Traditional Name: 3-(3-chlorobenzyl)-1-(1H-imidazol-5-ylmethyl)nipecotic acid ethyl ester Formula: C19H24ClN3O2 MolecularWeight: 361.86576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24ClN3O2/c1-2-25-18(24)19(10-15-5-3-6-16(20)9-15)7-4-8-23(13-19)12-17-11-21-14-22-17/h3,5-6,9,11,14H,2,4,7-8,10,12-13H2,1H3,(H,21,22)