methyl 3-[2-[(4-bromophenyl)sulfonyl-(4-ethoxyphenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[(4-bromophenyl)sulfonyl-(4-ethoxyphenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(N-(4-bromophenyl)sulfonyl-4-ethoxy-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(N-(4-bromophenyl)sulfonyl-4-ethoxyanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(N-(4-bromophenyl)sulfonyl-4-ethoxyanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(N-brosyl-4-ethoxy-anilino)acetyl]amino]benzoic acid methyl ester Formula: C24H23BrN2O6S MolecularWeight: 547.41822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C24H23BrN2O6S/c1-3-33-21-11-9-20(10-12-21)27(34(30,31)22-13-7-18(25)8-14-22)16-23(28)26-19-6-4-5-17(15-19)24(29)32-2/h4-15H,3,16H2,1-2H3,(H,26,28)