2,5,7,9a-tetramethyl-10,10-bis(oxidanylidene)-4a,9-dihydrothioxanthene-4-carboxylic acid

Systemtic Name: 2,5,7,9a-tetramethyl-10,10-bis(oxidanylidene)-4a,9-dihydrothioxanthene-4-carboxylic acid Openeye Name: 2,5,7,9a-tetramethyl-10,10-dioxo-4a,9-dihydrothioxanthene-4-carboxylic acid CAS Name: 2,5,7,9a-tetramethyl-10,10-dioxo-4a,9-dihydrothioxanthene-4-carboxylic acid IUPAC Name: 2,5,7,9a-tetramethyl-10,10-dioxo-4a,9-dihydrothioxanthene-4-carboxylic acid Traditional Name: 10,10-diketo-2,5,7,9a-tetramethyl-4a,9-dihydrothioxanthene-4-carboxylic acid Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)CC3(C=C(C=C(C3S2(=O)=O)C(=O)O)C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)CC3(C=C(C=C(C3S2(=O)=O)C(=O)O)C)C)C

InChI

InChI=1S/C18H20O4S/c1-10-5-12(3)15-13(6-10)9-18(4)8-11(2)7-14(17(19)20)16(18)23(15,21)22/h5-8,16H,9H2,1-4H3,(H,19,20)