ethyl 2-[[3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-4-(4-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-4-(4-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-4-(4-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[3-(4-chlorophenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-(4-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino]-4-(4-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[[3-(4-chlorophenyl)-2-cyano-acryloyl]amino]-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H16ClN3O5S MolecularWeight: 481.90824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C(=CC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C(=CC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C23H16ClN3O5S/c1-2-32-23(29)20-19(15-5-9-18(10-6-15)27(30)31)13-33-22(20)26-21(28)16(12-25)11-14-3-7-17(24)8-4-14/h3-11,13H,2H2,1H3,(H,26,28)