[2-(trifluoromethyl)phenyl]methyl 1,3-benzothiazole-6-carboxylate

Systemtic Name: [2-(trifluoromethyl)phenyl]methyl 1,3-benzothiazole-6-carboxylate Openeye Name: [2-(trifluoromethyl)phenyl]methyl 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-(trifluoromethyl)phenyl]methyl 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-(trifluoromethyl)benzyl] ester Formula: C16H10F3NO2S MolecularWeight: 337.31631

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CC3=C(C=C2)N=CS3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CC3=C(C=C2)N=CS3)C(F)(F)F

InChI

InChI=1S/C16H10F3NO2S/c17-16(18,19)12-4-2-1-3-11(12)8-22-15(21)10-5-6-13-14(7-10)23-9-20-13/h1-7,9H,8H2