ethyl 2-[2-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(2-bromo-4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-5-methyl-4-(4-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-bromo-4-chloro-3,5-dimethylphenoxy)acetyl]amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C24H22BrClN2O6S MolecularWeight: 581.86328

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-])C)NC(=O)COC3=C(C(=C(C(=C3)C)Cl)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C24H22BrClN2O6S/c1-5-33-24(30)20-19(15-6-8-16(9-7-15)28(31)32)14(4)35-23(20)27-18(29)11-34-17-10-12(2)22(26)13(3)21(17)25/h6-10H,5,11H2,1-4H3,(H,27,29)