dimethyl 5-[2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[(4-bromophenyl)sulfonyl-methyl-amino]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(4-bromophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[(4-bromophenyl)sulfonyl-methylamino]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[brosyl(methyl)amino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H19BrN2O7S MolecularWeight: 499.33236

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H19BrN2O7S/c1-22(30(26,27)16-6-4-14(20)5-7-16)11-17(23)21-15-9-12(18(24)28-2)8-13(10-15)19(25)29-3/h4-10H,11H2,1-3H3,(H,21,23)