8-(trifluoromethyl)-4H-1,5-benzothiazepine-5-carboxylate

Systemtic Name: 8-(trifluoromethyl)-4H-1,5-benzothiazepine-5-carboxylate Openeye Name: 8-(trifluoromethyl)-4H-1,5-benzothiazepine-5-carboxylate CAS Name: 8-(trifluoromethyl)-4H-1,5-benzothiazepine-5-carboxylate IUPAC Name: 8-(trifluoromethyl)-4H-1,5-benzothiazepine-5-carboxylate Traditional Name: 8-(trifluoromethyl)-4H-1,5-benzothiazepine-5-carboxylate Formula: C11H7F3NO2S- MolecularWeight: 274.23899

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CSC2=C(N1C(=O)[O-])C=CC(=C2)C(F)(F)F

Isomeric SMILES

C1C=CSC2=C(N1C(=O)[O-])C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C11H8F3NO2S/c12-11(13,14)7-2-3-8-9(6-7)18-5-1-4-15(8)10(16)17/h1-3,5-6H,4H2,(H,16,17)/p-1