ethyl 4-(3-nitrophenyl)-2-[2-(4-phenylphenoxy)propanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3-nitrophenyl)-2-[2-(4-phenylphenoxy)propanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3-nitrophenyl)-2-[2-(4-phenylphenoxy)propanoylamino]thiophene-3-carboxylate CAS Name: 4-(3-nitrophenyl)-2-[[1-oxo-2-(4-phenylphenoxy)propyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrophenyl)-2-[2-(4-phenylphenoxy)propanoylamino]thiophene-3-carboxylate Traditional Name: 4-(3-nitrophenyl)-2-[2-(4-phenylphenoxy)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C28H24N2O6S MolecularWeight: 516.56496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C(C)OC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C(C)OC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H24N2O6S/c1-3-35-28(32)25-24(21-10-7-11-22(16-21)30(33)34)17-37-27(25)29-26(31)18(2)36-23-14-12-20(13-15-23)19-8-5-4-6-9-19/h4-18H,3H2,1-2H3,(H,29,31)