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2-[4-[[[4-(1-oxidanylhexyl)phenyl]methyl-pyridin-3-ylsulfonyl-amino]methyl]phenoxy]ethanoic acid

2-[4-[[[4-(1-oxidanylhexyl)phenyl]methyl-pyridin-3-ylsulfonyl-amino]methyl]phenoxy]ethanoic acid

Systemtic Name:2-[4-[[[4-(1-oxidanylhexyl)phenyl]methyl-pyridin-3-ylsulfonyl-amino]methyl]phenoxy]ethanoic acid
Openeye Name:2-[4-[[[4-(1-hydroxyhexyl)phenyl]methyl-(3-pyridylsulfonyl)amino]methyl]phenoxy]acetic acid
CAS Name:2-[4-[[[4-(1-hydroxyhexyl)phenyl]methyl-(3-pyridinylsulfonyl)amino]methyl]phenoxy]acetic acid
IUPAC Name:2-[4-[[[4-(1-hydroxyhexyl)phenyl]methyl-pyridin-3-ylsulfonylamino]methyl]phenoxy]acetic acid
Traditional Name:2-[4-[[[4-(1-hydroxyhexyl)benzyl]-(3-pyridylsulfonyl)amino]methyl]phenoxy]acetic acid
Formula: C27H32N2O6S
MolecularWeight: 512.61778
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)OCC(=O)O)S(=O)(=O)C3=CN=CC=C3)O


Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)OCC(=O)O)S(=O)(=O)C3=CN=CC=C3)O


InChI

InChI=1S/C27H32N2O6S/c1-2-3-4-7-26(30)23-12-8-21(9-13-23)18-29(36(33,34)25-6-5-16-28-17-25)19-22-10-14-24(15-11-22)35-20-27(31)32/h5-6,8-17,26,30H,2-4,7,18-20H2,1H3,(H,31,32)


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