6-oxidanylidene-5H-benzo[b][1]benzothiepine-2-carboxylic acid

Systemtic Name: 6-oxidanylidene-5H-benzo[b][1]benzothiepine-2-carboxylic acid Openeye Name: 6-oxo-5H-benzo[b][1]benzothiepine-2-carboxylic acid CAS Name: 6-oxo-5H-benzo[b][1]benzothiepin-2-carboxylic acid IUPAC Name: 6-oxo-5H-benzo[b][1]benzothiepine-2-carboxylic acid Traditional Name: 6-keto-5H-benzo[b][1]benzothiepin-2-carboxylic acid Formula: C15H10O3S MolecularWeight: 270.3031

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C(=O)O)SC3=CC=CC=C3C1=O

Isomeric SMILES

C1C2=C(C=C(C=C2)C(=O)O)SC3=CC=CC=C3C1=O

InChI

InChI=1S/C15H10O3S/c16-12-7-9-5-6-10(15(17)18)8-14(9)19-13-4-2-1-3-11(12)13/h1-6,8H,7H2,(H,17,18)