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18-oxidanyl-2-(phenylmethyl)octadecanoate

18-oxidanyl-2-(phenylmethyl)octadecanoate

Systemtic Name:18-oxidanyl-2-(phenylmethyl)octadecanoate
Openeye Name:2-benzyl-18-hydroxy-octadecanoate
CAS Name:18-hydroxy-2-(phenylmethyl)octadecanoate
IUPAC Name:2-benzyl-18-hydroxyoctadecanoate
Traditional Name:2-benzyl-18-hydroxy-stearate
Formula: C25H41O3-
MolecularWeight: 389.59124
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCCCCCCCCCCCCCCCO)C(=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)CC(CCCCCCCCCCCCCCCCO)C(=O)[O-]


InChI

InChI=1S/C25H42O3/c26-21-17-12-10-8-6-4-2-1-3-5-7-9-11-16-20-24(25(27)28)22-23-18-14-13-15-19-23/h13-15,18-19,24,26H,1-12,16-17,20-22H2,(H,27,28)/p-1


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