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2-butyl-2-ethyl-3-hexadecyl-icosanoic acid

2-butyl-2-ethyl-3-hexadecyl-icosanoic acid

Systemtic Name:2-butyl-2-ethyl-3-hexadecyl-icosanoic acid
Openeye Name:2-butyl-2-ethyl-3-hexadecyl-icosanoic acid
CAS Name:2-butyl-2-ethyl-3-hexadecyleicosanoic acid
IUPAC Name:2-butyl-2-ethyl-3-hexadecylicosanoic acid
Traditional Name:2-butyl-3-cetyl-2-ethyl-arachidic acid
Formula: C42H84O2
MolecularWeight: 621.11516
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C(CC)(CCCC)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C(CC)(CCCC)C(=O)O


InChI

InChI=1S/C42H84O2/c1-5-9-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40(42(8-4,41(43)44)39-11-7-3)37-35-33-31-29-27-25-23-21-19-17-15-13-10-6-2/h40H,5-39H2,1-4H3,(H,43,44)


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