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phenyl 3-pentyloctadecanoate

phenyl 3-pentyloctadecanoate

Systemtic Name:phenyl 3-pentyloctadecanoate
Openeye Name:phenyl 3-pentyloctadecanoate
CAS Name:3-pentyloctadecanoic acid phenyl ester
IUPAC Name:phenyl 3-pentyloctadecanoate
Traditional Name:3-amylstearic acid phenyl ester
Formula: C29H50O2
MolecularWeight: 430.7061
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CCCCC)CC(=O)OC1=CC=CC=C1


Isomeric SMILES

CCCCCCCCCCCCCCCC(CCCCC)CC(=O)OC1=CC=CC=C1


InChI

InChI=1S/C29H50O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-19-23-27(22-18-6-4-2)26-29(30)31-28-24-20-17-21-25-28/h17,20-21,24-25,27H,3-16,18-19,22-23,26H2,1-2H3


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