1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclobutane-1-carbonitrile

Systemtic Name: 1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclobutane-1-carbonitrile Openeye Name: 1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclobutanecarbonitrile CAS Name: 1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-1-cyclobutanecarbonitrile IUPAC Name: 1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclobutane-1-carbonitrile Traditional Name: 1-[3-methylol-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclobutanecarbonitrile Formula: C15H16N4O MolecularWeight: 268.31374

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C#N)C2=CC(=CC(=C2)CO)CN3C=NC=N3

Isomeric SMILES

C1CC(C1)(C#N)C2=CC(=CC(=C2)CO)CN3C=NC=N3

InChI

InChI=1S/C15H16N4O/c16-9-15(2-1-3-15)14-5-12(4-13(6-14)8-20)7-19-11-17-10-18-19/h4-6,10-11,20H,1-3,7-8H2