2-(2-methylbutylsulfanyl)isoindole-1,3-dione chloride

Systemtic Name: 2-(2-methylbutylsulfanyl)isoindole-1,3-dione chloride Openeye Name: 2-(2-methylbutylsulfanyl)isoindoline-1,3-dione chloride CAS Name: 2-(2-methylbutylthio)isoindole-1,3-dione chloride IUPAC Name: 2-(2-methylbutylsulfanyl)isoindole-1,3-dione chloride Traditional Name: 2-(2-methylbutylthio)isoindoline-1,3-quinone chloride Formula: C13H14ClNO2S MolecularWeight: 283.77376

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Descriptors Computed from Structure

Canonical SMILES:

C[CH+]C(C)CSN1C(=O)C2=CC=CC=C2C1=O.[Cl-]

Isomeric SMILES

C[CH+]C(C)CSN1C(=O)C2=CC=CC=C2C1=O.[Cl-]

InChI

InChI=1S/C13H14NO2S.ClH/c1-3-9(2)8-17-14-12(15)10-6-4-5-7-11(10)13(14)16;/h3-7,9H,8H2,1-2H3;1H/q+1;/p-1