ethyl 3-[3-(4-methoxyphenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-[3-(4-methoxyphenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylate Openeye Name: ethyl 3-[3-(4-methoxyphenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylate CAS Name: 3-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-5-(3-nitrophenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-(4-methoxyphenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylate Traditional Name: 3-[3-(4-methoxyphenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylic acid ethyl ester Formula: C23H22N2O6S MolecularWeight: 454.49558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H22N2O6S/c1-3-31-23(27)22-19(14-20(32-22)16-5-4-6-17(13-16)25(28)29)24-21(26)12-9-15-7-10-18(30-2)11-8-15/h4-8,10-11,13-14H,3,9,12H2,1-2H3,(H,24,26)