5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carboxylic acid

Systemtic Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carboxylic acid Openeye Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carboxylic acid CAS Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carboxylic acid IUPAC Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carboxylic acid Traditional Name: 5,6-dihydrobenzo[b][1,4]benzothiazepine-2-carboxylic acid Formula: C14H11NO2S MolecularWeight: 257.30764

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2SC3=C(N1)C=CC(=C3)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2SC3=C(N1)C=CC(=C3)C(=O)O

InChI

InChI=1S/C14H11NO2S/c16-14(17)9-5-6-11-13(7-9)18-12-4-2-1-3-10(12)8-15-11/h1-7,15H,8H2,(H,16,17)