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

Systemtic Name: 2-(1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C11H11N3O2 MolecularWeight: 217.22394

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)C3=CNN=C3

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)C3=CNN=C3

InChI

InChI=1S/C11H11N3O2/c15-10-8-3-1-2-4-9(8)11(16)14(10)7-5-12-13-6-7/h1-2,5-6,8-9H,3-4H2,(H,12,13)