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4-[2-(2-carboxyethyl)-3-[6-(3-pyridin-4-yl-5-thiophen-3-yl-phenoxy)hexyl]phenoxy]butanoic acid

4-[2-(2-carboxyethyl)-3-[6-(3-pyridin-4-yl-5-thiophen-3-yl-phenoxy)hexyl]phenoxy]butanoic acid

Systemtic Name:4-[2-(2-carboxyethyl)-3-[6-(3-pyridin-4-yl-5-thiophen-3-yl-phenoxy)hexyl]phenoxy]butanoic acid
Openeye Name:4-[2-(2-carboxyethyl)-3-[6-[3-(4-pyridyl)-5-(3-thienyl)phenoxy]hexyl]phenoxy]butanoic acid
CAS Name:4-[2-(2-carboxyethyl)-3-[6-[3-pyridin-4-yl-5-(3-thiophenyl)phenoxy]hexyl]phenoxy]butanoic acid
IUPAC Name:4-[2-(2-carboxyethyl)-3-[6-(3-pyridin-4-yl-5-thiophen-3-ylphenoxy)hexyl]phenoxy]butanoic acid
Traditional Name:4-[2-(2-carboxyethyl)-3-[6-[3-(4-pyridyl)-5-(3-thienyl)phenoxy]hexyl]phenoxy]butyric acid
Formula: C34H37NO6S
MolecularWeight: 587.72568
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OCCCC(=O)O)CCC(=O)O)CCCCCCOC2=CC(=CC(=C2)C3=CSC=C3)C4=CC=NC=C4


Isomeric SMILES

C1=CC(=C(C(=C1)OCCCC(=O)O)CCC(=O)O)CCCCCCOC2=CC(=CC(=C2)C3=CSC=C3)C4=CC=NC=C4


InChI

InChI=1S/C34H37NO6S/c36-33(37)10-6-19-41-32-9-5-8-26(31(32)11-12-34(38)39)7-3-1-2-4-18-40-30-22-28(25-13-16-35-17-14-25)21-29(23-30)27-15-20-42-24-27/h5,8-9,13-17,20-24H,1-4,6-7,10-12,18-19H2,(H,36,37)(H,38,39)


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