ethyl 4-[2-[(4-bromophenyl)sulfonyl-ethyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(4-bromophenyl)sulfonyl-ethyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(4-bromophenyl)sulfonyl-ethyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(4-bromophenyl)sulfonyl-ethylamino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-bromophenyl)sulfonyl-ethylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[brosyl(ethyl)amino]acetyl]amino]benzoic acid ethyl ester Formula: C19H21BrN2O5S MolecularWeight: 469.34944

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC=C(C=C1)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCN(CC(=O)NC1=CC=C(C=C1)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H21BrN2O5S/c1-3-22(28(25,26)17-11-7-15(20)8-12-17)13-18(23)21-16-9-5-14(6-10-16)19(24)27-4-2/h5-12H,3-4,13H2,1-2H3,(H,21,23)