5-methylisoindole-1,3-dione dihydrochloride

Systemtic Name: 5-methylisoindole-1,3-dione dihydrochloride Openeye Name: 5-methylisoindoline-1,3-dione dihydrochloride CAS Name: 5-methylisoindole-1,3-dione dihydrochloride IUPAC Name: 5-methylisoindole-1,3-dione dihydrochloride Traditional Name: 5-methylisoindoline-1,3-quinone dihydrochloride Formula: C9H9Cl2NO2 MolecularWeight: 234.07926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)NC2=O.Cl.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)NC2=O.Cl.Cl

InChI

InChI=1S/C9H7NO2.2ClH/c1-5-2-3-6-7(4-5)9(12)10-8(6)11;;/h2-4H,1H3,(H,10,11,12);2*1H