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[2-[4-(4-hexylphenyl)phenyl]pyrimidin-5-yl] 2-butoxypropanoate

[2-[4-(4-hexylphenyl)phenyl]pyrimidin-5-yl] 2-butoxypropanoate

Systemtic Name:[2-[4-(4-hexylphenyl)phenyl]pyrimidin-5-yl] 2-butoxypropanoate
Openeye Name:[2-[4-(4-hexylphenyl)phenyl]pyrimidin-5-yl] 2-butoxypropanoate
CAS Name:2-butoxypropanoic acid [2-[4-(4-hexylphenyl)phenyl]-5-pyrimidinyl] ester
IUPAC Name:[2-[4-(4-hexylphenyl)phenyl]pyrimidin-5-yl] 2-butoxypropanoate
Traditional Name:2-butoxypropionic acid [2-[4-(4-hexylphenyl)phenyl]pyrimidin-5-yl] ester
Formula: C29H36N2O3
MolecularWeight: 460.60774
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(=O)C(C)OCCCC


Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(=O)C(C)OCCCC


InChI

InChI=1S/C29H36N2O3/c1-4-6-8-9-10-23-11-13-24(14-12-23)25-15-17-26(18-16-25)28-30-20-27(21-31-28)34-29(32)22(3)33-19-7-5-2/h11-18,20-22H,4-10,19H2,1-3H3


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