7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-carboxylate

Systemtic Name: 7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: 7-oxo-5,6-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylate IUPAC Name: 7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 7-keto-5,6-dihydro-4H-benzothiophene-3-carboxylate Formula: C9H7O3S- MolecularWeight: 195.21508

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)SC=C2C(=O)[O-]

Isomeric SMILES

C1CC2=C(C(=O)C1)SC=C2C(=O)[O-]

InChI

InChI=1S/C9H8O3S/c10-7-3-1-2-5-6(9(11)12)4-13-8(5)7/h4H,1-3H2,(H,11,12)/p-1