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4-[4-(1-hydroxyethyl)-8-oxidanyl-tridecyl]benzoic acid

4-[4-(1-hydroxyethyl)-8-oxidanyl-tridecyl]benzoic acid

Systemtic Name:4-[4-(1-hydroxyethyl)-8-oxidanyl-tridecyl]benzoic acid
Openeye Name:4-[8-hydroxy-4-(1-hydroxyethyl)tridecyl]benzoic acid
CAS Name:4-[8-hydroxy-4-(1-hydroxyethyl)tridecyl]benzoic acid
IUPAC Name:4-[8-hydroxy-4-(1-hydroxyethyl)tridecyl]benzoic acid
Traditional Name:4-[8-hydroxy-4-(1-hydroxyethyl)tridecyl]benzoic acid
Formula: C22H36O4
MolecularWeight: 364.51884
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCC1=CC=C(C=C1)C(=O)O)C(C)O)O


Isomeric SMILES

CCCCCC(CCCC(CCCC1=CC=C(C=C1)C(=O)O)C(C)O)O


InChI

InChI=1S/C22H36O4/c1-3-4-5-11-21(24)12-7-10-19(17(2)23)9-6-8-18-13-15-20(16-14-18)22(25)26/h13-17,19,21,23-24H,3-12H2,1-2H3,(H,25,26)


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