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

Systemtic Name: ethyl 2-[2-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(2-bromo-4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-4-(3-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-bromo-4-chloro-3,5-dimethylphenoxy)acetyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H20BrClN2O6S MolecularWeight: 567.8367

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20BrClN2O6S/c1-4-32-23(29)19-16(14-6-5-7-15(9-14)27(30)31)11-34-22(19)26-18(28)10-33-17-8-12(2)21(25)13(3)20(17)24/h5-9,11H,4,10H2,1-3H3,(H,26,28)