5-fluoranyl-11-oxidanylidene-benzo[b][1]benzothiepine-2-carboxylic acid

Systemtic Name: 5-fluoranyl-11-oxidanylidene-benzo[b][1]benzothiepine-2-carboxylic acid Openeye Name: 5-fluoro-11-oxo-benzo[b][1]benzothiepine-2-carboxylic acid CAS Name: 5-fluoro-11-oxo-2-benzo[b][1]benzothiepincarboxylic acid IUPAC Name: 5-fluoro-11-oxobenzo[b][1]benzothiepine-2-carboxylic acid Traditional Name: 5-fluoro-11-keto-benzo[b][1]benzothiepin-2-carboxylic acid Formula: C15H9FO3S MolecularWeight: 288.293563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=C(S2=O)C=C(C=C3)C(=O)O)F

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=C(S2=O)C=C(C=C3)C(=O)O)F

InChI

InChI=1S/C15H9FO3S/c16-12-7-9-3-1-2-4-13(9)20(19)14-8-10(15(17)18)5-6-11(12)14/h1-8H,(H,17,18)