7a-(trichloromethylsulfanyl)-4,5-dihydro-3aH-isoindole-1,3-dione

Systemtic Name: 7a-(trichloromethylsulfanyl)-4,5-dihydro-3aH-isoindole-1,3-dione Openeye Name: 7a-(trichloromethylsulfanyl)-4,5-dihydro-3aH-isoindole-1,3-dione CAS Name: 7a-(trichloromethylthio)-4,5-dihydro-3aH-isoindole-1,3-dione IUPAC Name: 7a-(trichloromethylsulfanyl)-4,5-dihydro-3aH-isoindole-1,3-dione Traditional Name: 7a-(trichloromethylthio)-4,5-dihydro-3aH-isoindole-1,3-quinone Formula: C9H8Cl3NO2S MolecularWeight: 300.58932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(=O)NC(=O)C2(C=C1)SC(Cl)(Cl)Cl

Isomeric SMILES

C1CC2C(=O)NC(=O)C2(C=C1)SC(Cl)(Cl)Cl

InChI

InChI=1S/C9H8Cl3NO2S/c10-9(11,12)16-8-4-2-1-3-5(8)6(14)13-7(8)15/h2,4-5H,1,3H2,(H,13,14,15)