2-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylthio]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-acetamidophenyl)sulfonylamino]ethylthio]phenoxy]acetic acid Formula: C18H20N2O6S2 MolecularWeight: 424.4912

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCSC2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCSC2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C18H20N2O6S2/c1-13(21)20-14-2-8-17(9-3-14)28(24,25)19-10-11-27-16-6-4-15(5-7-16)26-12-18(22)23/h2-9,19H,10-12H2,1H3,(H,20,21)(H,22,23)