2,2,3-trimethyl-1,1-bis(oxidanylidene)-3,4-dihydrothiochromene-6-carboxylic acid

Systemtic Name: 2,2,3-trimethyl-1,1-bis(oxidanylidene)-3,4-dihydrothiochromene-6-carboxylic acid Openeye Name: 2,2,3-trimethyl-1,1-dioxo-3,4-dihydrothiochromene-6-carboxylic acid CAS Name: 2,2,3-trimethyl-1,1-dioxo-3,4-dihydro-1-benzothiopyran-6-carboxylic acid IUPAC Name: 2,2,3-trimethyl-1,1-dioxo-3,4-dihydrothiochromene-6-carboxylic acid Traditional Name: 1,1-diketo-2,2,3-trimethyl-3,4-dihydrothiochromene-6-carboxylic acid Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=CC(=C2)C(=O)O)S(=O)(=O)C1(C)C

Isomeric SMILES

CC1CC2=C(C=CC(=C2)C(=O)O)S(=O)(=O)C1(C)C

InChI

InChI=1S/C13H16O4S/c1-8-6-10-7-9(12(14)15)4-5-11(10)18(16,17)13(8,2)3/h4-5,7-8H,6H2,1-3H3,(H,14,15)