ethyl 2-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C18H14F7NO3S MolecularWeight: 457.362482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

InChI

InChI=1S/C18H14F7NO3S/c1-3-29-14(27)12-11(10-6-4-9(2)5-7-10)8-30-13(12)26-15(28)16(19,20)17(21,22)18(23,24)25/h4-8H,3H2,1-2H3,(H,26,28)