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3-[4-decoxy-3-(3-oxidanylpropyl)phenoxy]benzoic acid

3-[4-decoxy-3-(3-oxidanylpropyl)phenoxy]benzoic acid

Systemtic Name:3-[4-decoxy-3-(3-oxidanylpropyl)phenoxy]benzoic acid
Openeye Name:3-[4-decoxy-3-(3-hydroxypropyl)phenoxy]benzoic acid
CAS Name:3-[4-decoxy-3-(3-hydroxypropyl)phenoxy]benzoic acid
IUPAC Name:3-[4-decoxy-3-(3-hydroxypropyl)phenoxy]benzoic acid
Traditional Name:3-[4-decoxy-3-(3-hydroxypropyl)phenoxy]benzoic acid
Formula: C26H36O5
MolecularWeight: 428.56104
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)OC2=CC=CC(=C2)C(=O)O)CCCO


Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)OC2=CC=CC(=C2)C(=O)O)CCCO


InChI

InChI=1S/C26H36O5/c1-2-3-4-5-6-7-8-9-18-30-25-16-15-24(19-21(25)13-11-17-27)31-23-14-10-12-22(20-23)26(28)29/h10,12,14-16,19-20,27H,2-9,11,13,17-18H2,1H3,(H,28,29)


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