4-[imidazol-1-yl-(1-oxidanylcyclopentyl)methyl]benzenecarbonitrile

Systemtic Name: 4-[imidazol-1-yl-(1-oxidanylcyclopentyl)methyl]benzenecarbonitrile Openeye Name: 4-[(1-hydroxycyclopentyl)-imidazol-1-yl-methyl]benzonitrile CAS Name: 4-[(1-hydroxycyclopentyl)-(1-imidazolyl)methyl]benzonitrile IUPAC Name: 4-[(1-hydroxycyclopentyl)-imidazol-1-ylmethyl]benzonitrile Traditional Name: 4-[(1-hydroxycyclopentyl)-imidazol-1-yl-methyl]benzonitrile Formula: C16H17N3O MolecularWeight: 267.32568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(C2=CC=C(C=C2)C#N)N3C=CN=C3)O

Isomeric SMILES

C1CCC(C1)(C(C2=CC=C(C=C2)C#N)N3C=CN=C3)O

InChI

InChI=1S/C16H17N3O/c17-11-13-3-5-14(6-4-13)15(19-10-9-18-12-19)16(20)7-1-2-8-16/h3-6,9-10,12,15,20H,1-2,7-8H2