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2-(14-heptylheptacosan-14-yl)hexanedioic acid

2-(14-heptylheptacosan-14-yl)hexanedioic acid

Systemtic Name:2-(14-heptylheptacosan-14-yl)hexanedioic acid
Openeye Name:2-(1-heptyl-1-tridecyl-tetradecyl)hexanedioic acid
CAS Name:2-(14-heptylheptacosan-14-yl)hexanedioic acid
IUPAC Name:2-(14-heptylheptacosan-14-yl)hexanedioic acid
Traditional Name:2-(1-heptyl-1-tridecyl-tetradecyl)adipic acid
Formula: C40H78O4
MolecularWeight: 623.04492
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCCCCCC)(CCCCCCCCCCCCC)C(CCCC(=O)O)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCC(CCCCCCC)(CCCCCCCCCCCCC)C(CCCC(=O)O)C(=O)O


InChI

InChI=1S/C40H78O4/c1-4-7-10-13-15-17-19-21-23-26-29-35-40(34-28-25-12-9-6-3,37(39(43)44)32-31-33-38(41)42)36-30-27-24-22-20-18-16-14-11-8-5-2/h37H,4-36H2,1-3H3,(H,41,42)(H,43,44)


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