sodium 2-[4-[2-[(4-chlorophenyl)sulfonylamino]propyl]phenoxy]-2-methyl-propanoate

Systemtic Name: sodium 2-[4-[2-[(4-chlorophenyl)sulfonylamino]propyl]phenoxy]-2-methyl-propanoate Openeye Name: sodium 2-[4-[2-[(4-chlorophenyl)sulfonylamino]propyl]phenoxy]-2-methyl-propanoate CAS Name: sodium 2-[4-[2-[(4-chlorophenyl)sulfonylamino]propyl]phenoxy]-2-methylpropanoate IUPAC Name: sodium 2-[4-[2-[(4-chlorophenyl)sulfonylamino]propyl]phenoxy]-2-methylpropanoate Traditional Name: sodium 2-[4-[2-[(4-chlorophenyl)sulfonylamino]propyl]phenoxy]-2-methyl-propionate Formula: C19H21ClNNaO5S MolecularWeight: 433.88151

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)OC(C)(C)C(=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)Cl.[Na+]

Isomeric SMILES

CC(CC1=CC=C(C=C1)OC(C)(C)C(=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)Cl.[Na+]

InChI

InChI=1S/C19H22ClNO5S.Na/c1-13(21-27(24,25)17-10-6-15(20)7-11-17)12-14-4-8-16(9-5-14)26-19(2,3)18(22)23;/h4-11,13,21H,12H2,1-3H3,(H,22,23);/q;+1/p-1