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

Systemtic Name: 2-[2-[(4-ethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoic acid Openeye Name: 2-[[2-[4-ethoxy-N-(p-tolylsulfonyl)anilino]acetyl]amino]benzoic acid CAS Name: 2-[[2-(4-ethoxy-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-(4-ethoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzoic acid Traditional Name: 2-[[2-(4-ethoxy-N-tosyl-anilino)acetyl]amino]benzoic acid Formula: C24H24N2O6S MolecularWeight: 468.52216

Click to see the large picture

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)C

Isomeric SMILES

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

InChI

InChI=1S/C24H24N2O6S/c1-3-32-19-12-10-18(11-13-19)26(33(30,31)20-14-8-17(2)9-15-20)16-23(27)25-22-7-5-4-6-21(22)24(28)29/h4-15H,3,16H2,1-2H3,(H,25,27)(H,28,29)