2-(2-ethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile

Systemtic Name: 2-(2-ethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile Openeye Name: 2-(2-ethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile CAS Name: 2-(2-ethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile IUPAC Name: 2-(2-ethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile Traditional Name: 2-o-phenetyl-2-(1,2,4-triazol-1-ylmethyl)valeronitrile Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CN1C=NC=N1)(C#N)C2=CC=CC=C2OCC

Isomeric SMILES

CCCC(CN1C=NC=N1)(C#N)C2=CC=CC=C2OCC

InChI

InChI=1S/C16H20N4O/c1-3-9-16(10-17,11-20-13-18-12-19-20)14-7-5-6-8-15(14)21-4-2/h5-8,12-13H,3-4,9,11H2,1-2H3