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4-(3,4-dioctadecoxyphenyl)butanoic acid

4-(3,4-dioctadecoxyphenyl)butanoic acid

Systemtic Name:4-(3,4-dioctadecoxyphenyl)butanoic acid
Openeye Name:4-(3,4-dioctadecoxyphenyl)butanoic acid
CAS Name:4-(3,4-dioctadecoxyphenyl)butanoic acid
IUPAC Name:4-(3,4-dioctadecoxyphenyl)butanoic acid
Traditional Name:4-(3,4-distearyloxyphenyl)butyric acid
Formula: C46H84O4
MolecularWeight: 701.15676
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)CCCC(=O)O)OCCCCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)CCCC(=O)O)OCCCCCCCCCCCCCCCCCC


InChI

InChI=1S/C46H84O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40-49-44-39-38-43(36-35-37-46(47)48)42-45(44)50-41-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h38-39,42H,3-37,40-41H2,1-2H3,(H,47,48)


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