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octyl 4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]benzoate

octyl 4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]benzoate

Systemtic Name:octyl 4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]benzoate
Openeye Name:octyl 4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]benzoate
CAS Name:4-[[4-(5-nonyl-2-pyrimidinyl)phenoxy]methyl]benzoic acid octyl ester
IUPAC Name:octyl 4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]benzoate
Traditional Name:4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]benzoic acid octyl ester
Formula: C35H48N2O3
MolecularWeight: 544.76722
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OCCCCCCCC


Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OCCCCCCCC


InChI

InChI=1S/C35H48N2O3/c1-3-5-7-9-11-12-14-16-30-26-36-34(37-27-30)31-21-23-33(24-22-31)40-28-29-17-19-32(20-18-29)35(38)39-25-15-13-10-8-6-4-2/h17-24,26-27H,3-16,25,28H2,1-2H3


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