5-(4-ethanoylphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione

Systemtic Name: 5-(4-ethanoylphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione Openeye Name: 5-(4-acetylphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione CAS Name: 5-(4-acetylphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione IUPAC Name: 5-(4-acetylphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione Traditional Name: 5-(4-acetylphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-quinone Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)C3CN=NC3C2=O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3CN=NC3C2=O

InChI

InChI=1S/C13H11N3O3/c1-7(17)8-2-4-9(5-3-8)16-12(18)10-6-14-15-11(10)13(16)19/h2-5,10-11H,6H2,1H3