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[4-[2-(4-pentoxyphenyl)pyrimidin-5-yl]phenyl] 4-methylhexanoate

[4-[2-(4-pentoxyphenyl)pyrimidin-5-yl]phenyl] 4-methylhexanoate

Systemtic Name:[4-[2-(4-pentoxyphenyl)pyrimidin-5-yl]phenyl] 4-methylhexanoate
Openeye Name:[4-[2-(4-pentoxyphenyl)pyrimidin-5-yl]phenyl] 4-methylhexanoate
CAS Name:4-methylhexanoic acid [4-[2-(4-pentoxyphenyl)-5-pyrimidinyl]phenyl] ester
IUPAC Name:[4-[2-(4-pentoxyphenyl)pyrimidin-5-yl]phenyl] 4-methylhexanoate
Traditional Name:4-methylhexanoic acid [4-[2-(4-amoxyphenyl)pyrimidin-5-yl]phenyl] ester
Formula: C28H34N2O3
MolecularWeight: 446.58116
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCC(C)CC


Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCC(C)CC


InChI

InChI=1S/C28H34N2O3/c1-4-6-7-18-32-25-13-11-23(12-14-25)28-29-19-24(20-30-28)22-9-15-26(16-10-22)33-27(31)17-8-21(3)5-2/h9-16,19-21H,4-8,17-18H2,1-3H3


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