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

Systemtic Name: 2-[[4-chloranyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]carbonyl]-5-methyl-cyclohexane-1,3-dione Openeye Name: 2-(4-chloro-1,1-dioxo-2,3-dihydrobenzothiophene-5-carbonyl)-5-methyl-cyclohexane-1,3-dione CAS Name: 2-[(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-oxomethyl]-5-methylcyclohexane-1,3-dione IUPAC Name: 2-(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophene-5-carbonyl)-5-methylcyclohexane-1,3-dione Traditional Name: 2-(4-chloro-1,1-diketo-2,3-dihydrobenzothiophene-5-carbonyl)-5-methyl-cyclohexane-1,3-quinone Formula: C16H15ClO5S MolecularWeight: 354.8053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C(=O)C1)C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CC3)Cl

Isomeric SMILES

CC1CC(=O)C(C(=O)C1)C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CC3)Cl

InChI

InChI=1S/C16H15ClO5S/c1-8-6-11(18)14(12(19)7-8)16(20)10-2-3-13-9(15(10)17)4-5-23(13,21)22/h2-3,8,14H,4-7H2,1H3