ethyl 4-(3,4-dimethylphenyl)-2-[2-(2-nitrophenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethylphenyl)-2-[2-(2-nitrophenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethylphenyl)-2-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(3,4-dimethylphenyl)-2-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethylphenyl)-2-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethylphenyl)-2-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-3-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(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H22N2O6S/c1-4-30-23(27)21-17(16-10-9-14(2)15(3)11-16)13-32-22(21)24-20(26)12-31-19-8-6-5-7-18(19)25(28)29/h5-11,13H,4,12H2,1-3H3,(H,24,26)