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

Systemtic Name: 4-phenoxy-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Openeye Name: 4-phenoxy-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile CAS Name: 4-phenoxy-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile IUPAC Name: 4-phenoxy-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Traditional Name: 4-phenoxy-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butyronitrile Formula: C19H18N4O MolecularWeight: 318.37242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCOC2=CC=CC=C2)(CN3C=NC=N3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCOC2=CC=CC=C2)(CN3C=NC=N3)C#N

InChI

InChI=1S/C19H18N4O/c20-13-19(14-23-16-21-15-22-23,17-7-3-1-4-8-17)11-12-24-18-9-5-2-6-10-18/h1-10,15-16H,11-12,14H2