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

Systemtic Name: 2-[[2,4-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]-oxidanyl-methylidene]cyclohexane-1,3-dione Openeye Name: 2-[(2,4-dimethyl-1,1-dioxo-2,3-dihydrobenzothiophen-5-yl)-hydroxy-methylene]cyclohexane-1,3-dione CAS Name: 2-[(2,4-dimethyl-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-hydroxymethylidene]cyclohexane-1,3-dione IUPAC Name: 2-[(2,4-dimethyl-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-hydroxymethylidene]cyclohexane-1,3-dione Traditional Name: 2-[(1,1-diketo-2,4-dimethyl-2,3-dihydrobenzothiophen-5-yl)-hydroxy-methylene]cyclohexane-1,3-quinone Formula: C17H18O5S MolecularWeight: 334.38682

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(S1(=O)=O)C=CC(=C2C)C(=C3C(=O)CCCC3=O)O

Isomeric SMILES

CC1CC2=C(S1(=O)=O)C=CC(=C2C)C(=C3C(=O)CCCC3=O)O

InChI

InChI=1S/C17H18O5S/c1-9-8-12-10(2)11(6-7-15(12)23(9,21)22)17(20)16-13(18)4-3-5-14(16)19/h6-7,9,20H,3-5,8H2,1-2H3