2-[1-(3-methyl-4-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl]sulfanylisoindole-1,3-dione

Systemtic Name: 2-[1-(3-methyl-4-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl]sulfanylisoindole-1,3-dione Openeye Name: 2-[2-(4-hydroxy-3-methyl-phenyl)-1-methyl-2-oxo-ethyl]sulfanylisoindoline-1,3-dione CAS Name: 2-[[1-(4-hydroxy-3-methylphenyl)-1-oxopropan-2-yl]thio]isoindole-1,3-dione IUPAC Name: 2-[1-(4-hydroxy-3-methylphenyl)-1-oxopropan-2-yl]sulfanylisoindole-1,3-dione Traditional Name: 2-[[2-(4-hydroxy-3-methyl-phenyl)-2-keto-1-methyl-ethyl]thio]isoindoline-1,3-quinone Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C(C)SN2C(=O)C3=CC=CC=C3C2=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C(C)SN2C(=O)C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C18H15NO4S/c1-10-9-12(7-8-15(10)20)16(21)11(2)24-19-17(22)13-5-3-4-6-14(13)18(19)23/h3-9,11,20H,1-2H3