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

Systemtic Name: 1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclopropane-1-carbonitrile Openeye Name: 1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclopropanecarbonitrile CAS Name: 1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-1-cyclopropanecarbonitrile IUPAC Name: 1-[3-(hydroxymethyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclopropane-1-carbonitrile Traditional Name: 1-[3-methylol-5-(1,2,4-triazol-1-ylmethyl)phenyl]cyclopropanecarbonitrile Formula: C14H14N4O MolecularWeight: 254.28716

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C#N)C2=CC(=CC(=C2)CO)CN3C=NC=N3

Isomeric SMILES

C1CC1(C#N)C2=CC(=CC(=C2)CO)CN3C=NC=N3

InChI

InChI=1S/C14H14N4O/c15-8-14(1-2-14)13-4-11(3-12(5-13)7-19)6-18-10-16-9-17-18/h3-5,9-10,19H,1-2,6-7H2