2-(2-ethoxyphenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile

Systemtic Name: 2-(2-ethoxyphenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Openeye Name: 2-(2-ethoxyphenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile CAS Name: 2-(2-ethoxyphenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile IUPAC Name: 2-(2-ethoxyphenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Traditional Name: 2-o-phenetyl-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butyronitrile Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(CCC2=CC=CC=C2)(CN3C=NC=N3)C#N

Isomeric SMILES

CCOC1=CC=CC=C1C(CCC2=CC=CC=C2)(CN3C=NC=N3)C#N

InChI

InChI=1S/C21H22N4O/c1-2-26-20-11-7-6-10-19(20)21(14-22,15-25-17-23-16-24-25)13-12-18-8-4-3-5-9-18/h3-11,16-17H,2,12-13,15H2,1H3