3-fluoranyl-5-oxidanylidene-6H-benzo[b][1]benzothiepine-7-carboxylic acid

Systemtic Name: 3-fluoranyl-5-oxidanylidene-6H-benzo[b][1]benzothiepine-7-carboxylic acid Openeye Name: 3-fluoro-5-oxo-6H-benzo[b][1]benzothiepine-7-carboxylic acid CAS Name: 3-fluoro-5-oxo-6H-benzo[b][1]benzothiepin-7-carboxylic acid IUPAC Name: 3-fluoro-5-oxo-6H-benzo[b][1]benzothiepine-7-carboxylic acid Traditional Name: 3-fluoro-5-keto-6H-benzo[b][1]benzothiepin-7-carboxylic acid Formula: C15H9FO3S MolecularWeight: 288.293563

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC=C2SC3=C(C1=O)C=C(C=C3)F)C(=O)O

Isomeric SMILES

C1C2=C(C=CC=C2SC3=C(C1=O)C=C(C=C3)F)C(=O)O

InChI

InChI=1S/C15H9FO3S/c16-8-4-5-14-11(6-8)12(17)7-10-9(15(18)19)2-1-3-13(10)20-14/h1-6H,7H2,(H,18,19)