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

Systemtic Name: methyl 5-(2,6,6-trimethyl-1-oxidanyl-4-oxidanylidene-cyclohex-2-en-1-yl)thiophene-2-carboxylate Openeye Name: methyl 5-(1-hydroxy-2,6,6-trimethyl-4-oxo-cyclohex-2-en-1-yl)thiophene-2-carboxylate CAS Name: 5-(1-hydroxy-2,6,6-trimethyl-4-oxo-1-cyclohex-2-enyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)thiophene-2-carboxylate Traditional Name: 5-(1-hydroxy-4-keto-2,6,6-trimethyl-cyclohex-2-en-1-yl)thiophene-2-carboxylic acid methyl ester 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)OC)O)(C)C

Isomeric SMILES

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

InChI

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