[(E)-2-[(E)-hexadec-7-enyl]icos-11-enyl] octadecanoate

Systemtic Name: [(E)-2-[(E)-hexadec-7-enyl]icos-11-enyl] octadecanoate Openeye Name: [(E)-2-[(E)-hexadec-7-enyl]icos-11-enyl] octadecanoate CAS Name: octadecanoic acid [(E)-2-[(E)-hexadec-7-enyl]eicos-11-enyl] ester IUPAC Name: [(E)-2-[(E)-hexadec-7-enyl]icos-11-enyl] octadecanoate Traditional Name: stearic acid [(E)-2-[(E)-hexadec-7-enyl]eicos-11-enyl] ester Formula: C54H104O2 MolecularWeight: 785.40236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CCCCCCCCC=CCCCCCCCC)CCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CCCCCCCC/C=C/CCCCCCCC)CCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C54H104O2/c1-4-7-10-13-16-19-22-25-28-30-32-35-38-41-44-47-50-53(49-46-43-40-37-34-31-27-24-21-18-15-12-9-6-3)52-56-54(55)51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h25,27-28,31,53H,4-24,26,29-30,32-52H2,1-3H3/b28-25+,31-27+