4-methoxy-5,8-dimethyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromene-6-carboxylic acid

Systemtic Name: 4-methoxy-5,8-dimethyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromene-6-carboxylic acid Openeye Name: 4-methoxy-5,8-dimethyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carboxylic acid CAS Name: 4-methoxy-5,8-dimethyl-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-6-carboxylic acid IUPAC Name: 4-methoxy-5,8-dimethyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carboxylic acid Traditional Name: 1,1-diketo-4-methoxy-5,8-dimethyl-3,4-dihydro-2H-thiochromene-6-carboxylic acid Formula: C13H16O5S MolecularWeight: 284.32814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1)C(=O)O)C)C(CCS2(=O)=O)OC

Isomeric SMILES

CC1=C2C(=C(C(=C1)C(=O)O)C)C(CCS2(=O)=O)OC

InChI

InChI=1S/C13H16O5S/c1-7-6-9(13(14)15)8(2)11-10(18-3)4-5-19(16,17)12(7)11/h6,10H,4-5H2,1-3H3,(H,14,15)