3,4,7-trimethyl-1,1-bis(oxidanylidene)-2,7a-dihydro-1-benzothiophene-5-carboxylic acid

Systemtic Name: 3,4,7-trimethyl-1,1-bis(oxidanylidene)-2,7a-dihydro-1-benzothiophene-5-carboxylic acid Openeye Name: 3,4,7-trimethyl-1,1-dioxo-2,7a-dihydrobenzothiophene-5-carboxylic acid CAS Name: 3,4,7-trimethyl-1,1-dioxo-2,7a-dihydro-1-benzothiophene-5-carboxylic acid IUPAC Name: 3,4,7-trimethyl-1,1-dioxo-2,7a-dihydro-1-benzothiophene-5-carboxylic acid Traditional Name: 1,1-diketo-3,4,7-trimethyl-2,7a-dihydrobenzothiophene-5-carboxylic acid Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(C(=CC(=C2C)C(=O)O)C)S(=O)(=O)C1

Isomeric SMILES

CC1=C2C(C(=CC(=C2C)C(=O)O)C)S(=O)(=O)C1

InChI

InChI=1S/C12H14O4S/c1-6-4-9(12(13)14)8(3)10-7(2)5-17(15,16)11(6)10/h4,11H,5H2,1-3H3,(H,13,14)