13-dodecyldotriacontan-14-yl hexanoate

Systemtic Name: 13-dodecyldotriacontan-14-yl hexanoate Openeye Name: 1-(1-dodecyltridecyl)nonadecyl hexanoate CAS Name: hexanoic acid 13-dodecyldotriacontan-14-yl ester IUPAC Name: 13-dodecyldotriacontan-14-yl hexanoate Traditional Name: hexanoic acid 1-(1-lauryltridecyl)nonadecyl ester Formula: C50H100O2 MolecularWeight: 733.3278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCC)CCCCCCCCCCCC)OC(=O)CCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCC)CCCCCCCCCCCC)OC(=O)CCCCC

InChI

InChI=1S/C50H100O2/c1-5-9-13-16-19-22-25-26-27-28-29-30-33-36-39-43-46-49(52-50(51)47-40-12-8-4)48(44-41-37-34-31-23-20-17-14-10-6-2)45-42-38-35-32-24-21-18-15-11-7-3/h48-49H,5-47H2,1-4H3