thieno[2,3-b][1]benzothiepine-4-carboxylic acid

Systemtic Name: thieno[2,3-b][1]benzothiepine-4-carboxylic acid Openeye Name: thieno[2,3-b][1]benzothiepine-4-carboxylic acid CAS Name: 4-thieno[2,3-b][1]benzothiepincarboxylic acid IUPAC Name: thieno[2,3-b][1]benzothiepine-4-carboxylic acid Traditional Name: thieno[2,3-b][1]benzothiepin-4-carboxylic acid Formula: C13H8O2S2 MolecularWeight: 260.33142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8O2S2/c14-12(15)10-7-8-3-1-2-4-11(8)17-13-9(10)5-6-16-13/h1-7H,(H,14,15)