3-methyl-5-(2,6,6-trimethyl-1-oxidanyl-4-oxidanylidene-cyclohex-2-en-1-yl)thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-(2,6,6-trimethyl-1-oxidanyl-4-oxidanylidene-cyclohex-2-en-1-yl)thiophene-2-carboxylic acid Openeye Name: 5-(1-hydroxy-2,6,6-trimethyl-4-oxo-cyclohex-2-en-1-yl)-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-(1-hydroxy-2,6,6-trimethyl-4-oxo-1-cyclohex-2-enyl)-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylthiophene-2-carboxylic acid Traditional Name: 5-(1-hydroxy-4-keto-2,6,6-trimethyl-cyclohex-2-en-1-yl)-3-methyl-2-thenoic acid Formula: C15H18O4S MolecularWeight: 294.36602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)CC(C1(C2=CC(=C(S2)C(=O)O)C)O)(C)C

Isomeric SMILES

CC1=CC(=O)CC(C1(C2=CC(=C(S2)C(=O)O)C)O)(C)C

InChI

InChI=1S/C15H18O4S/c1-8-5-11(20-12(8)13(17)18)15(19)9(2)6-10(16)7-14(15,3)4/h5-6,19H,7H2,1-4H3,(H,17,18)