10-oxidanyl-5,6-dihydrobenzo[b][1]benzothiepine-4-carboxylic acid

Systemtic Name: 10-oxidanyl-5,6-dihydrobenzo[b][1]benzothiepine-4-carboxylic acid Openeye Name: 10-hydroxy-5,6-dihydrobenzo[b][1]benzothiepine-4-carboxylic acid CAS Name: 10-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-4-carboxylic acid IUPAC Name: 10-hydroxy-5,6-dihydrobenzo[b][1]benzothiepine-4-carboxylic acid Traditional Name: 10-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-4-carboxylic acid Formula: C15H12O3S MolecularWeight: 272.31898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2SC3=C1C=CC=C3O)C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2SC3=C1C=CC=C3O)C(=O)O

InChI

InChI=1S/C15H12O3S/c16-12-5-1-3-9-7-8-10-11(15(17)18)4-2-6-13(10)19-14(9)12/h1-6,16H,7-8H2,(H,17,18)