8-(trifluoromethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxylate

Systemtic Name: 8-(trifluoromethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxylate Openeye Name: 8-(trifluoromethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxylate CAS Name: 8-(trifluoromethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxylate IUPAC Name: 8-(trifluoromethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxylate Traditional Name: 8-(trifluoromethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxylate Formula: C11H9F3NO2S- MolecularWeight: 276.25487

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C(C=C(C=C2)C(F)(F)F)SC1)C(=O)[O-]

Isomeric SMILES

C1CN(C2=C(C=C(C=C2)C(F)(F)F)SC1)C(=O)[O-]

InChI

InChI=1S/C11H10F3NO2S/c12-11(13,14)7-2-3-8-9(6-7)18-5-1-4-15(8)10(16)17/h2-3,6H,1,4-5H2,(H,16,17)/p-1