2-[10,10-bis(oxidanylidene)-9H-thioxanthen-9-yl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[10,10-bis(oxidanylidene)-9H-thioxanthen-9-yl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-(10,10-dioxo-9H-thioxanthen-9-yl)-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-(10,10-dioxo-9H-thioxanthen-9-yl)-3-hydroxy-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-(10,10-dioxo-9H-thioxanthen-9-yl)-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-(10,10-diketo-9H-thioxanthen-9-yl)-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one Formula: C21H20O4S MolecularWeight: 368.4461

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C2C3=CC=CC=C3S(=O)(=O)C4=CC=CC=C24)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C2C3=CC=CC=C3S(=O)(=O)C4=CC=CC=C24)O)C

InChI

InChI=1S/C21H20O4S/c1-21(2)11-15(22)20(16(23)12-21)19-13-7-3-5-9-17(13)26(24,25)18-10-6-4-8-14(18)19/h3-10,19,22H,11-12H2,1-2H3