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

Systemtic Name: 5-(3-chloranyl-4-methyl-phenyl)-3-methyl-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione Openeye Name: 5-(3-chloro-4-methyl-phenyl)-3-methyl-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione CAS Name: 5-(3-chloro-4-methylphenyl)-3-methyl-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione IUPAC Name: 5-(3-chloro-4-methylphenyl)-3-methyl-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione Traditional Name: 5-(3-chloro-4-methyl-phenyl)-3-methyl-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-quinone Formula: C13H12ClN3O2 MolecularWeight: 277.70628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)N=N1

Isomeric SMILES

CC1C2C(C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)N=N1

InChI

InChI=1S/C13H12ClN3O2/c1-6-3-4-8(5-9(6)14)17-12(18)10-7(2)15-16-11(10)13(17)19/h3-5,7,10-11H,1-2H3