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3-heptanoyloxy-2-pentyl-dodecanoic acid

3-heptanoyloxy-2-pentyl-dodecanoic acid

Systemtic Name:3-heptanoyloxy-2-pentyl-dodecanoic acid
Openeye Name:3-heptanoyloxy-2-pentyl-dodecanoic acid
CAS Name:3-(1-oxoheptoxy)-2-pentyldodecanoic acid
IUPAC Name:3-heptanoyloxy-2-pentyldodecanoic acid
Traditional Name:2-amyl-3-enanthyloxy-lauric acid
Formula: C24H46O4
MolecularWeight: 398.61964
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(CCCCC)C(=O)O)OC(=O)CCCCCC


Isomeric SMILES

CCCCCCCCCC(C(CCCCC)C(=O)O)OC(=O)CCCCCC


InChI

InChI=1S/C24H46O4/c1-4-7-10-12-13-14-16-19-22(21(24(26)27)18-15-9-6-3)28-23(25)20-17-11-8-5-2/h21-22H,4-20H2,1-3H3,(H,26,27)


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