2-[[4,7-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]carbonyl]cyclohexane-1,3-dione

Systemtic Name: 2-[[4,7-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]carbonyl]cyclohexane-1,3-dione Openeye Name: 2-(4,7-dimethyl-1,1-dioxo-2,3-dihydrobenzothiophene-5-carbonyl)cyclohexane-1,3-dione CAS Name: 2-[(4,7-dimethyl-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-oxomethyl]cyclohexane-1,3-dione IUPAC Name: 2-(4,7-dimethyl-1,1-dioxo-2,3-dihydro-1-benzothiophene-5-carbonyl)cyclohexane-1,3-dione Traditional Name: 2-(1,1-diketo-4,7-dimethyl-2,3-dihydrobenzothiophene-5-carbonyl)cyclohexane-1,3-quinone Formula: C17H18O5S MolecularWeight: 334.38682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1)C(=O)C3C(=O)CCCC3=O)C)CCS2(=O)=O

Isomeric SMILES

CC1=C2C(=C(C(=C1)C(=O)C3C(=O)CCCC3=O)C)CCS2(=O)=O

InChI

InChI=1S/C17H18O5S/c1-9-8-12(10(2)11-6-7-23(21,22)17(9)11)16(20)15-13(18)4-3-5-14(15)19/h8,15H,3-7H2,1-2H3