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1-[4-(5-octoxypyrimidin-2-yl)phenoxy]propan-2-yl octanoate

1-[4-(5-octoxypyrimidin-2-yl)phenoxy]propan-2-yl octanoate

Systemtic Name:1-[4-(5-octoxypyrimidin-2-yl)phenoxy]propan-2-yl octanoate
Openeye Name:[1-methyl-2-[4-(5-octoxypyrimidin-2-yl)phenoxy]ethyl] octanoate
CAS Name:octanoic acid 1-[4-(5-octoxy-2-pyrimidinyl)phenoxy]propan-2-yl ester
IUPAC Name:1-[4-(5-octoxypyrimidin-2-yl)phenoxy]propan-2-yl octanoate
Traditional Name:caprylic acid [1-methyl-2-[4-(5-octoxypyrimidin-2-yl)phenoxy]ethyl] ester
Formula: C29H44N2O4
MolecularWeight: 484.67066
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C)OC(=O)CCCCCCC


Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C)OC(=O)CCCCCCC


InChI

InChI=1S/C29H44N2O4/c1-4-6-8-10-12-14-20-33-27-21-30-29(31-22-27)25-16-18-26(19-17-25)34-23-24(3)35-28(32)15-13-11-9-7-5-2/h16-19,21-22,24H,4-15,20,23H2,1-3H3


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