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2-[4-(5-hexylpyrimidin-2-yl)phenoxy]propyl heptanoate

2-[4-(5-hexylpyrimidin-2-yl)phenoxy]propyl heptanoate

Systemtic Name:2-[4-(5-hexylpyrimidin-2-yl)phenoxy]propyl heptanoate
Openeye Name:2-[4-(5-hexylpyrimidin-2-yl)phenoxy]propyl heptanoate
CAS Name:heptanoic acid 2-[4-(5-hexyl-2-pyrimidinyl)phenoxy]propyl ester
IUPAC Name:2-[4-(5-hexylpyrimidin-2-yl)phenoxy]propyl heptanoate
Traditional Name:enanthic acid 2-[4-(5-hexylpyrimidin-2-yl)phenoxy]propyl ester
Formula: C26H38N2O3
MolecularWeight: 426.59152
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(C)COC(=O)CCCCCC


Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(C)COC(=O)CCCCCC


InChI

InChI=1S/C26H38N2O3/c1-4-6-8-10-12-22-18-27-26(28-19-22)23-14-16-24(17-15-23)31-21(3)20-30-25(29)13-11-9-7-5-2/h14-19,21H,4-13,20H2,1-3H3


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