2-[2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[4-[methyl(p-tolylsulfonyl)amino]phenoxy]acetyl]amino]acetic acid CAS Name: 2-[[2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetyl]amino]acetic acid Traditional Name: 2-[[2-[4-[methyl(tosyl)amino]phenoxy]acetyl]amino]acetic acid Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)NCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)NCC(=O)O

InChI

InChI=1S/C18H20N2O6S/c1-13-3-9-16(10-4-13)27(24,25)20(2)14-5-7-15(8-6-14)26-12-17(21)19-11-18(22)23/h3-10H,11-12H2,1-2H3,(H,19,21)(H,22,23)