1-[2-oxidanyl-4-phenyl-1-(1,2,4-triazol-1-yl)butan-2-yl]cyclopropane-1-carbonitrile

Systemtic Name: 1-[2-oxidanyl-4-phenyl-1-(1,2,4-triazol-1-yl)butan-2-yl]cyclopropane-1-carbonitrile Openeye Name: 1-[1-hydroxy-3-phenyl-1-(1,2,4-triazol-1-ylmethyl)propyl]cyclopropanecarbonitrile CAS Name: 1-[2-hydroxy-4-phenyl-1-(1,2,4-triazol-1-yl)butan-2-yl]-1-cyclopropanecarbonitrile IUPAC Name: 1-[2-hydroxy-4-phenyl-1-(1,2,4-triazol-1-yl)butan-2-yl]cyclopropane-1-carbonitrile Traditional Name: 1-[1-hydroxy-3-phenyl-1-(1,2,4-triazol-1-ylmethyl)propyl]cyclopropanecarbonitrile Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C#N)C(CCC2=CC=CC=C2)(CN3C=NC=N3)O

Isomeric SMILES

C1CC1(C#N)C(CCC2=CC=CC=C2)(CN3C=NC=N3)O

InChI

InChI=1S/C16H18N4O/c17-10-15(8-9-15)16(21,11-20-13-18-12-19-20)7-6-14-4-2-1-3-5-14/h1-5,12-13,21H,6-9,11H2