4-[6-(hydroxymethyl)-3-[8-(4-methoxyphenyl)octoxy]pyridin-2-yl]butanoic acid

Systemtic Name: 4-[6-(hydroxymethyl)-3-[8-(4-methoxyphenyl)octoxy]pyridin-2-yl]butanoic acid Openeye Name: 4-[6-(hydroxymethyl)-3-[8-(4-methoxyphenyl)octoxy]-2-pyridyl]butanoic acid CAS Name: 4-[6-(hydroxymethyl)-3-[8-(4-methoxyphenyl)octoxy]-2-pyridinyl]butanoic acid IUPAC Name: 4-[6-(hydroxymethyl)-3-[8-(4-methoxyphenyl)octoxy]pyridin-2-yl]butanoic acid Traditional Name: 4-[3-[8-(4-methoxyphenyl)octoxy]-6-methylol-2-pyridyl]butyric acid Formula: C25H35NO5 MolecularWeight: 429.5491

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCCCCCCOC2=C(N=C(C=C2)CO)CCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCCCCCCCOC2=C(N=C(C=C2)CO)CCCC(=O)O

InChI

InChI=1S/C25H35NO5/c1-30-22-15-12-20(13-16-22)9-6-4-2-3-5-7-18-31-24-17-14-21(19-27)26-23(24)10-8-11-25(28)29/h12-17,27H,2-11,18-19H2,1H3,(H,28,29)