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

Systemtic Name: 4-[imidazol-1-yl-(1-oxidanylcycloheptyl)methyl]benzenecarbonitrile Openeye Name: 4-[(1-hydroxycycloheptyl)-imidazol-1-yl-methyl]benzonitrile CAS Name: 4-[(1-hydroxycycloheptyl)-(1-imidazolyl)methyl]benzonitrile IUPAC Name: 4-[(1-hydroxycycloheptyl)-imidazol-1-ylmethyl]benzonitrile Traditional Name: 4-[(1-hydroxycycloheptyl)-imidazol-1-yl-methyl]benzonitrile Formula: C18H21N3O MolecularWeight: 295.37884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(C2=CC=C(C=C2)C#N)N3C=CN=C3)O

Isomeric SMILES

C1CCCC(CC1)(C(C2=CC=C(C=C2)C#N)N3C=CN=C3)O

InChI

InChI=1S/C18H21N3O/c19-13-15-5-7-16(8-6-15)17(21-12-11-20-14-21)18(22)9-3-1-2-4-10-18/h5-8,11-12,14,17,22H,1-4,9-10H2