1-[4-(5-octoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate

Systemtic Name: 1-[4-(5-octoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate Openeye Name: [1-methyl-2-[4-(5-octoxypyrimidin-2-yl)phenyl]ethyl] butanoate CAS Name: butanoic acid 1-[4-(5-octoxy-2-pyrimidinyl)phenyl]propan-2-yl ester IUPAC Name: 1-[4-(5-octoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate Traditional Name: butyric acid [1-methyl-2-[4-(5-octoxypyrimidin-2-yl)phenyl]ethyl] ester Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36N2O3/c1-4-6-7-8-9-10-16-29-23-18-26-25(27-19-23)22-14-12-21(13-15-22)17-20(3)30-24(28)11-5-2/h12-15,18-20H,4-11,16-17H2,1-3H3