methyl 4-(4-fluorophenyl)-5-methyl-2-[2-(4-nitrophenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-fluorophenyl)-5-methyl-2-[2-(4-nitrophenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-fluorophenyl)-5-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-5-methyl-2-[[2-(4-nitrophenoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluorophenyl)-5-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-5-methyl-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C21H17FN2O6S MolecularWeight: 444.432883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H17FN2O6S/c1-12-18(13-3-5-14(22)6-4-13)19(21(26)29-2)20(31-12)23-17(25)11-30-16-9-7-15(8-10-16)24(27)28/h3-10H,11H2,1-2H3,(H,23,25)