2-(3-methyl-5-oxidanylidene-1H-1,2,4-triazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(3-methyl-5-oxidanylidene-1H-1,2,4-triazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(5-keto-3-methyl-1H-1,2,4-triazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C11H12N4O3 MolecularWeight: 248.23798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)N1N2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

CC1=NNC(=O)N1N2C(=O)C3CC=CCC3C2=O

InChI

InChI=1S/C11H12N4O3/c1-6-12-13-11(18)14(6)15-9(16)7-4-2-3-5-8(7)10(15)17/h2-3,7-8H,4-5H2,1H3,(H,13,18)