4-[(1-oxidanylcyclohexyl)-(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(1-oxidanylcyclohexyl)-(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(1-hydroxycyclohexyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile CAS Name: 4-[(1-hydroxycyclohexyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile IUPAC Name: 4-[(1-hydroxycyclohexyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Traditional Name: 4-[(1-hydroxycyclohexyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(C2=CC=C(C=C2)C#N)C3=NC=NN3)O

Isomeric SMILES

C1CCC(CC1)(C(C2=CC=C(C=C2)C#N)C3=NC=NN3)O

InChI

InChI=1S/C16H18N4O/c17-10-12-4-6-13(7-5-12)14(15-18-11-19-20-15)16(21)8-2-1-3-9-16/h4-7,11,14,21H,1-3,8-9H2,(H,18,19,20)