2-[4-[[methylsulfonyl(4-oxidanylnonyl)amino]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[[methylsulfonyl(4-oxidanylnonyl)amino]methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[[4-hydroxynonyl(methylsulfonyl)amino]methyl]phenoxy]acetic acid CAS Name: 2-[4-[[4-hydroxynonyl(methylsulfonyl)amino]methyl]phenoxy]acetic acid IUPAC Name: 2-[4-[[4-hydroxynonyl(methylsulfonyl)amino]methyl]phenoxy]acetic acid Traditional Name: 2-[4-[[4-hydroxynonyl(mesyl)amino]methyl]phenoxy]acetic acid Formula: C19H31NO6S MolecularWeight: 401.51754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCN(CC1=CC=C(C=C1)OCC(=O)O)S(=O)(=O)C)O

Isomeric SMILES

CCCCCC(CCCN(CC1=CC=C(C=C1)OCC(=O)O)S(=O)(=O)C)O

InChI

InChI=1S/C19H31NO6S/c1-3-4-5-7-17(21)8-6-13-20(27(2,24)25)14-16-9-11-18(12-10-16)26-15-19(22)23/h9-12,17,21H,3-8,13-15H2,1-2H3,(H,22,23)