2-(3,5-dimethyl-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)N2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

CC1=C(C(=NN1)C)N2C(=O)C3CC=CCC3C2=O

InChI

InChI=1S/C13H15N3O2/c1-7-11(8(2)15-14-7)16-12(17)9-5-3-4-6-10(9)13(16)18/h3-4,9-10H,5-6H2,1-2H3,(H,14,15)