7-(trifluoromethyl)-1,5-dihydro-4,1-benzothiazepine-3-carboxylate

Systemtic Name: 7-(trifluoromethyl)-1,5-dihydro-4,1-benzothiazepine-3-carboxylate Openeye Name: 7-(trifluoromethyl)-1,5-dihydro-4,1-benzothiazepine-3-carboxylate CAS Name: 7-(trifluoromethyl)-1,5-dihydro-4,1-benzothiazepine-3-carboxylate IUPAC Name: 7-(trifluoromethyl)-1,5-dihydro-4,1-benzothiazepine-3-carboxylate Traditional Name: 7-(trifluoromethyl)-1,5-dihydro-4,1-benzothiazepine-3-carboxylate Formula: C11H7F3NO2S- MolecularWeight: 274.23899

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C(F)(F)F)NC=C(S1)C(=O)[O-]

Isomeric SMILES

C1C2=C(C=CC(=C2)C(F)(F)F)NC=C(S1)C(=O)[O-]

InChI

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