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3-[3-(2-carboxyethyl)-4-decoxy-phenoxy]benzoic acid

3-[3-(2-carboxyethyl)-4-decoxy-phenoxy]benzoic acid

Systemtic Name:3-[3-(2-carboxyethyl)-4-decoxy-phenoxy]benzoic acid
Openeye Name:3-[3-(2-carboxyethyl)-4-decoxy-phenoxy]benzoic acid
CAS Name:3-[3-(2-carboxyethyl)-4-decoxyphenoxy]benzoic acid
IUPAC Name:3-[3-(2-carboxyethyl)-4-decoxyphenoxy]benzoic acid
Traditional Name:3-[3-(2-carboxyethyl)-4-decoxy-phenoxy]benzoic acid
Formula: C26H34O6
MolecularWeight: 442.54456
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C26H34O6/c1-2-3-4-5-6-7-8-9-17-31-24-15-14-23(18-20(24)13-16-25(27)28)32-22-12-10-11-21(19-22)26(29)30/h10-12,14-15,18-19H,2-9,13,16-17H2,1H3,(H,27,28)(H,29,30)


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