3-(1,3-benzodioxol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one CAS Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-1H-1,2,4-triazol-5-one Formula: C10H9N3O3 MolecularWeight: 219.19676

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C(=NNC1=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C10H9N3O3/c1-13-9(11-12-10(13)14)6-2-3-7-8(4-6)16-5-15-7/h2-4H,5H2,1H3,(H,12,14)