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4-[6-[2,3-bis(oxidanyl)phenyl]hexoxy]-3-propyl-benzoic acid

4-[6-[2,3-bis(oxidanyl)phenyl]hexoxy]-3-propyl-benzoic acid

Systemtic Name:4-[6-[2,3-bis(oxidanyl)phenyl]hexoxy]-3-propyl-benzoic acid
Openeye Name:4-[6-(2,3-dihydroxyphenyl)hexoxy]-3-propyl-benzoic acid
CAS Name:4-[6-(2,3-dihydroxyphenyl)hexoxy]-3-propylbenzoic acid
IUPAC Name:4-[6-(2,3-dihydroxyphenyl)hexoxy]-3-propylbenzoic acid
Traditional Name:4-[6-(2,3-dihydroxyphenyl)hexoxy]-3-propyl-benzoic acid
Formula: C22H28O5
MolecularWeight: 372.45472
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)O)OCCCCCCC2=C(C(=CC=C2)O)O


Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)O)OCCCCCCC2=C(C(=CC=C2)O)O


InChI

InChI=1S/C22H28O5/c1-2-8-17-15-18(22(25)26)12-13-20(17)27-14-6-4-3-5-9-16-10-7-11-19(23)21(16)24/h7,10-13,15,23-24H,2-6,8-9,14H2,1H3,(H,25,26)


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