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

Systemtic Name: 1-[4-(5-heptoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate Openeye Name: [2-[4-(5-heptoxypyrimidin-2-yl)phenyl]-1-methyl-ethyl] butanoate CAS Name: butanoic acid 1-[4-(5-heptoxy-2-pyrimidinyl)phenyl]propan-2-yl ester IUPAC Name: 1-[4-(5-heptoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate Traditional Name: butyric acid [2-[4-(5-heptoxypyrimidin-2-yl)phenyl]-1-methyl-ethyl] ester Formula: C24H34N2O3 MolecularWeight: 398.53836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCC

Isomeric SMILES

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCC

InChI

InChI=1S/C24H34N2O3/c1-4-6-7-8-9-15-28-22-17-25-24(26-18-22)21-13-11-20(12-14-21)16-19(3)29-23(27)10-5-2/h11-14,17-19H,4-10,15-16H2,1-3H3