2-(2-methylsulfanylphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-(2-methylsulfanylphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-(2-methylsulfanylphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-[2-(methylthio)phenyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-(2-methylsulfanylphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-[2-(methylthio)phenyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C15H17NO2S MolecularWeight: 275.36598

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1N2C(=O)C3CCCCC3C2=O

Isomeric SMILES

CSC1=CC=CC=C1N2C(=O)C3CCCCC3C2=O

InChI

InChI=1S/C15H17NO2S/c1-19-13-9-5-4-8-12(13)16-14(17)10-6-2-3-7-11(10)15(16)18/h4-5,8-11H,2-3,6-7H2,1H3