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

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

CC1CC2=C(S1(=O)=O)C=CC(=C2Cl)C(=C3C(=O)CCCC3=O)O

Isomeric SMILES

CC1CC2=C(S1(=O)=O)C=CC(=C2Cl)C(=C3C(=O)CCCC3=O)O

InChI

InChI=1S/C16H15ClO5S/c1-8-7-10-13(23(8,21)22)6-5-9(15(10)17)16(20)14-11(18)3-2-4-12(14)19/h5-6,8,20H,2-4,7H2,1H3