3-[3-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]pyridin-2-yl]propanoic acid

Systemtic Name: 3-[3-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]pyridin-2-yl]propanoic acid Openeye Name: 3-[3-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-pyridyl]propanoic acid CAS Name: 3-[3-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-pyridinyl]propanoic acid IUPAC Name: 3-[3-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]pyridin-2-yl]propanoic acid Traditional Name: 3-[3-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-pyridyl]propionic acid Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(N=CC=C2)CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(N=CC=C2)CCC(=O)O

InChI

InChI=1S/C22H27NO6/c1-3-6-17-19(10-8-16(15(2)24)22(17)27)28-13-5-14-29-20-7-4-12-23-18(20)9-11-21(25)26/h4,7-8,10,12,27H,3,5-6,9,11,13-14H2,1-2H3,(H,25,26)