ethyl 2-[2,2,2-tris(fluoranyl)ethanoylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2,2,2-tris(fluoranyl)ethanoylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(2,2,2-trifluoroacetyl)amino]benzothiophene-3-carboxylate CAS Name: 2-[(2,2,2-trifluoro-1-oxoethyl)amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2,2,2-trifluoroacetyl)amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[(2,2,2-trifluoroacetyl)amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C13H10F3NO3S MolecularWeight: 317.28361

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C(F)(F)F

InChI

InChI=1S/C13H10F3NO3S/c1-2-20-11(18)9-7-5-3-4-6-8(7)21-10(9)17-12(19)13(14,15)16/h3-6H,2H2,1H3,(H,17,19)