[3-(trifluoromethyl)phenyl]methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid [3-(trifluoromethyl)benzyl] ester Formula: C17H12F3NO3S MolecularWeight: 367.34229

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C17H12F3NO3S/c18-17(19,20)12-3-1-2-10(6-12)8-24-16(23)11-4-5-14-13(7-11)21-15(22)9-25-14/h1-7H,8-9H2,(H,21,22)