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4-(8-oxidanyl-4-propanoyl-tridecyl)benzoic acid

4-(8-oxidanyl-4-propanoyl-tridecyl)benzoic acid

Systemtic Name:4-(8-oxidanyl-4-propanoyl-tridecyl)benzoic acid
Openeye Name:4-(8-hydroxy-4-propanoyl-tridecyl)benzoic acid
CAS Name:4-[8-hydroxy-4-(1-oxopropyl)tridecyl]benzoic acid
IUPAC Name:4-(8-hydroxy-4-propanoyltridecyl)benzoic acid
Traditional Name:4-(8-hydroxy-4-propionyl-tridecyl)benzoic acid
Formula: C23H36O4
MolecularWeight: 376.52954
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C23H36O4/c1-3-5-6-12-21(24)13-8-11-19(22(25)4-2)10-7-9-18-14-16-20(17-15-18)23(26)27/h14-17,19,21,24H,3-13H2,1-2H3,(H,26,27)


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