4-(1-benzothiophen-3-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(1-benzothiophen-3-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(benzothiophen-3-yl)-4-oxo-butanoic acid CAS Name: 4-(1-benzothiophen-3-yl)-4-oxobutanoic acid IUPAC Name: 4-(1-benzothiophen-3-yl)-4-oxobutanoic acid Traditional Name: 4-(benzothiophen-3-yl)-4-keto-butyric acid Formula: C12H10O3S MolecularWeight: 234.271

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)C(=O)CCC(=O)O

InChI

InChI=1S/C12H10O3S/c13-10(5-6-12(14)15)9-7-16-11-4-2-1-3-8(9)11/h1-4,7H,5-6H2,(H,14,15)