4-ethyl-5-methyl-isoindole-1,3-dione dihydrochloride

Systemtic Name: 4-ethyl-5-methyl-isoindole-1,3-dione dihydrochloride Openeye Name: 4-ethyl-5-methyl-isoindoline-1,3-dione dihydrochloride CAS Name: 4-ethyl-5-methylisoindole-1,3-dione dihydrochloride IUPAC Name: 4-ethyl-5-methylisoindole-1,3-dione dihydrochloride Traditional Name: 4-ethyl-5-methyl-isoindoline-1,3-quinone dihydrochloride Formula: C11H13Cl2NO2 MolecularWeight: 262.13242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC2=C1C(=O)NC2=O)C.Cl.Cl

Isomeric SMILES

CCC1=C(C=CC2=C1C(=O)NC2=O)C.Cl.Cl

InChI

InChI=1S/C11H11NO2.2ClH/c1-3-7-6(2)4-5-8-9(7)11(14)12-10(8)13;;/h4-5H,3H2,1-2H3,(H,12,13,14);2*1H