5-(3-methylphenyl)-1,2-dihydro-1,2,4-triazol-3-one

Systemtic Name: 5-(3-methylphenyl)-1,2-dihydro-1,2,4-triazol-3-one Openeye Name: 5-(m-tolyl)-1,2-dihydro-1,2,4-triazol-3-one CAS Name: 5-(3-methylphenyl)-1,2-dihydro-1,2,4-triazol-3-one IUPAC Name: 5-(3-methylphenyl)-1,2-dihydro-1,2,4-triazol-3-one Traditional Name: 5-(m-tolyl)-1,2-dihydro-1,2,4-triazol-3-one Formula: C9H9N3O MolecularWeight: 175.18726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=O)NN2

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=O)NN2

InChI

InChI=1S/C9H9N3O/c1-6-3-2-4-7(5-6)8-10-9(13)12-11-8/h2-5H,1H3,(H2,10,11,12,13)