5-chloranyl-1-oxidanylidene-7-(phenylcarbonyl)-2,3-dihydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: 5-chloranyl-1-oxidanylidene-7-(phenylcarbonyl)-2,3-dihydro-1-benzothiophene-3-carboxylic acid Openeye Name: 7-benzoyl-5-chloro-1-oxo-2,3-dihydrobenzothiophene-3-carboxylic acid CAS Name: 7-benzoyl-5-chloro-1-oxo-2,3-dihydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 7-benzoyl-5-chloro-1-oxo-2,3-dihydro-1-benzothiophene-3-carboxylic acid Traditional Name: 7-benzoyl-5-chloro-1-keto-2,3-dihydrobenzothiophene-3-carboxylic acid Formula: C16H11ClO4S MolecularWeight: 334.77414

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(S1=O)C(=CC(=C2)Cl)C(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(C2=C(S1=O)C(=CC(=C2)Cl)C(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C16H11ClO4S/c17-10-6-11-13(16(19)20)8-22(21)15(11)12(7-10)14(18)9-4-2-1-3-5-9/h1-7,13H,8H2,(H,19,20)