2-[5-chloranyl-2-cyclopentyl-3-(phenylmethyl)imidazol-4-yl]ethanenitrile hydrochloride

Systemtic Name: 2-[5-chloranyl-2-cyclopentyl-3-(phenylmethyl)imidazol-4-yl]ethanenitrile hydrochloride Openeye Name: 2-(3-benzyl-5-chloro-2-cyclopentyl-imidazol-4-yl)acetonitrile hydrochloride CAS Name: 2-[5-chloro-2-cyclopentyl-3-(phenylmethyl)-4-imidazolyl]acetonitrile hydrochloride IUPAC Name: 2-(3-benzyl-5-chloro-2-cyclopentylimidazol-4-yl)acetonitrile hydrochloride Traditional Name: 2-(3-benzyl-5-chloro-2-cyclopentyl-imidazol-4-yl)acetonitrile hydrochloride Formula: C17H19Cl2N3 MolecularWeight: 336.25886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC(=C(N2CC3=CC=CC=C3)CC#N)Cl.Cl

Isomeric SMILES

C1CCC(C1)C2=NC(=C(N2CC3=CC=CC=C3)CC#N)Cl.Cl

InChI

InChI=1S/C17H18ClN3.ClH/c18-16-15(10-11-19)21(12-13-6-2-1-3-7-13)17(20-16)14-8-4-5-9-14;/h1-3,6-7,14H,4-5,8-10,12H2;1H