2-[[4-chloranyl-7-methyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]-oxidanyl-methylidene]cyclohexane-1,3-dione

Systemtic Name: 2-[[4-chloranyl-7-methyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]-oxidanyl-methylidene]cyclohexane-1,3-dione Openeye Name: 2-[(4-chloro-7-methyl-1,1-dioxo-2,3-dihydrobenzothiophen-5-yl)-hydroxy-methylene]cyclohexane-1,3-dione CAS Name: 2-[(4-chloro-7-methyl-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-hydroxymethylidene]cyclohexane-1,3-dione IUPAC Name: 2-[(4-chloro-7-methyl-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-hydroxymethylidene]cyclohexane-1,3-dione Traditional Name: 2-[(4-chloro-1,1-diketo-7-methyl-2,3-dihydrobenzothiophen-5-yl)-hydroxy-methylene]cyclohexane-1,3-quinone Formula: C16H15ClO5S MolecularWeight: 354.8053

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClO5S/c1-8-7-10(14(17)9-5-6-23(21,22)16(8)9)15(20)13-11(18)3-2-4-12(13)19/h7,20H,2-6H2,1H3