1-[(4-cyanophenyl)methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[(4-cyanophenyl)methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[(4-cyanophenyl)methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[(4-cyanophenyl)methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[(4-cyanophenyl)methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-(4-cyanobenzyl)-1,2,4-triazole-3-carbonitrile Formula: C11H7N5 MolecularWeight: 209.20678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC(=N2)C#N)C#N

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC(=N2)C#N)C#N

InChI

InChI=1S/C11H7N5/c12-5-9-1-3-10(4-2-9)7-16-8-14-11(6-13)15-16/h1-4,8H,7H2