2-[2-[(4-chlorophenyl)sulfonyl-(4-ethoxyphenyl)amino]ethanoylamino]benzoic acid

Systemtic Name: 2-[2-[(4-chlorophenyl)sulfonyl-(4-ethoxyphenyl)amino]ethanoylamino]benzoic acid Openeye Name: 2-[[2-(N-(4-chlorophenyl)sulfonyl-4-ethoxy-anilino)acetyl]amino]benzoic acid CAS Name: 2-[[2-(N-(4-chlorophenyl)sulfonyl-4-ethoxyanilino)-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-(N-(4-chlorophenyl)sulfonyl-4-ethoxyanilino)acetyl]amino]benzoic acid Traditional Name: 2-[[2-(N-(4-chlorophenyl)sulfonyl-4-ethoxy-anilino)acetyl]amino]benzoic acid Formula: C23H21ClN2O6S MolecularWeight: 488.94064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)O)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)O)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H21ClN2O6S/c1-2-32-18-11-9-17(10-12-18)26(33(30,31)19-13-7-16(24)8-14-19)15-22(27)25-21-6-4-3-5-20(21)23(28)29/h3-14H,2,15H2,1H3,(H,25,27)(H,28,29)