2-(phenylmethyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 2-(phenylmethyl)-1H-1,2,4-triazol-5-one Openeye Name: 2-benzyl-1H-1,2,4-triazol-5-one CAS Name: 2-(phenylmethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 2-benzyl-1H-1,2,4-triazol-5-one Traditional Name: 2-benzyl-1H-1,2,4-triazol-5-one Formula: C9H9N3O MolecularWeight: 175.18726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC(=O)N2

InChI

InChI=1S/C9H9N3O/c13-9-10-7-12(11-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,11,13)