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

Systemtic Name: 5,6-dihydrobenzo[b][1]benzothiepine-4-carboxylic acid Openeye Name: 5,6-dihydrobenzo[b][1]benzothiepine-4-carboxylic acid CAS Name: 5,6-dihydrobenzo[b][1]benzothiepin-4-carboxylic acid IUPAC Name: 5,6-dihydrobenzo[b][1]benzothiepine-4-carboxylic acid Traditional Name: 5,6-dihydrobenzo[b][1]benzothiepin-4-carboxylic acid Formula: C15H12O2S MolecularWeight: 256.31958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2SC3=CC=CC=C31)C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2SC3=CC=CC=C31)C(=O)O

InChI

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