2-(6-methylsulfanyl-5-oxidanylidene-hexyl)isoindole-1,3-dione

Systemtic Name: 2-(6-methylsulfanyl-5-oxidanylidene-hexyl)isoindole-1,3-dione Openeye Name: 2-(6-methylsulfanyl-5-oxo-hexyl)isoindoline-1,3-dione CAS Name: 2-[6-(methylthio)-5-oxohexyl]isoindole-1,3-dione IUPAC Name: 2-(6-methylsulfanyl-5-oxohexyl)isoindole-1,3-dione Traditional Name: 2-[5-keto-6-(methylthio)hexyl]isoindoline-1,3-quinone Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)CCCCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CSCC(=O)CCCCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C15H17NO3S/c1-20-10-11(17)6-4-5-9-16-14(18)12-7-2-3-8-13(12)15(16)19/h2-3,7-8H,4-6,9-10H2,1H3