ethyl 4-(3-nitrophenyl)-2-[2-(2,3,6-trimethylphenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3-nitrophenyl)-2-[2-(2,3,6-trimethylphenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3-nitrophenyl)-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(3-nitrophenyl)-2-[[1-oxo-2-(2,3,6-trimethylphenoxy)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrophenyl)-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(3-nitrophenyl)-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H24N2O6S MolecularWeight: 468.52216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)COC3=C(C=CC(=C3C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)COC3=C(C=CC(=C3C)C)C

InChI

InChI=1S/C24H24N2O6S/c1-5-31-24(28)21-19(17-7-6-8-18(11-17)26(29)30)13-33-23(21)25-20(27)12-32-22-15(3)10-9-14(2)16(22)4/h6-11,13H,5,12H2,1-4H3,(H,25,27)