4-[(2-hydroxyphenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(2-hydroxyphenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(2-hydroxyphenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile CAS Name: 4-[(2-hydroxyphenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile IUPAC Name: 4-[(2-hydroxyphenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Traditional Name: 4-[(2-hydroxyphenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Formula: C16H12N4O MolecularWeight: 276.29268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C2=CC=C(C=C2)C#N)C3=NC=NN3)O

Isomeric SMILES

C1=CC=C(C(=C1)C(C2=CC=C(C=C2)C#N)C3=NC=NN3)O

InChI

InChI=1S/C16H12N4O/c17-9-11-5-7-12(8-6-11)15(16-18-10-19-20-16)13-3-1-2-4-14(13)21/h1-8,10,15,21H,(H,18,19,20)