2-[3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)phenyl]carbonylthieno[2,3-b]thiophene-5-carboxylic acid

Systemtic Name: 2-[3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)phenyl]carbonylthieno[2,3-b]thiophene-5-carboxylic acid Openeye Name: 2-[3-(2-hydroxy-1-methyl-2-oxo-ethyl)benzoyl]thieno[2,3-b]thiophene-5-carboxylic acid CAS Name: 2-[[3-(1-hydroxy-1-oxopropan-2-yl)phenyl]-oxomethyl]-5-thieno[2,3-b]thiophenecarboxylic acid IUPAC Name: 2-[3-(1-hydroxy-1-oxopropan-2-yl)benzoyl]thieno[2,3-b]thiophene-5-carboxylic acid Traditional Name: 2-[3-(2-hydroxy-2-keto-1-methyl-ethyl)benzoyl]thieno[2,3-b]thiophene-5-carboxylic acid Formula: C17H12O5S2 MolecularWeight: 360.40418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC3=C(S2)SC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC3=C(S2)SC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C17H12O5S2/c1-8(15(19)20)9-3-2-4-10(5-9)14(18)12-6-11-7-13(16(21)22)24-17(11)23-12/h2-8H,1H3,(H,19,20)(H,21,22)