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

Systemtic Name: 5,6-dihydrobenzo[b][1]benzothiepine-5-carboxylic acid Openeye Name: 5,6-dihydrobenzo[b][1]benzothiepine-5-carboxylic acid CAS Name: 5,6-dihydrobenzo[b][1]benzothiepin-5-carboxylic acid IUPAC Name: 5,6-dihydrobenzo[b][1]benzothiepine-5-carboxylic acid Traditional Name: 5,6-dihydrobenzo[b][1]benzothiepin-5-carboxylic acid Formula: C15H12O2S MolecularWeight: 256.31958

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2SC3=CC=CC=C31)C(=O)O

Isomeric SMILES

C1C(C2=CC=CC=C2SC3=CC=CC=C31)C(=O)O

InChI

InChI=1S/C15H12O2S/c16-15(17)12-9-10-5-1-3-7-13(10)18-14-8-4-2-6-11(12)14/h1-8,12H,9H2,(H,16,17)