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

Systemtic Name: 1-[4-(5-hexoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate Openeye Name: [2-[4-(5-hexoxypyrimidin-2-yl)phenyl]-1-methyl-ethyl] butanoate CAS Name: butanoic acid 1-[4-(5-hexoxy-2-pyrimidinyl)phenyl]propan-2-yl ester IUPAC Name: 1-[4-(5-hexoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate Traditional Name: butyric acid [2-[4-(5-hexoxypyrimidin-2-yl)phenyl]-1-methyl-ethyl] ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCC

Isomeric SMILES

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCC

InChI

InChI=1S/C23H32N2O3/c1-4-6-7-8-14-27-21-16-24-23(25-17-21)20-12-10-19(11-13-20)15-18(3)28-22(26)9-5-2/h10-13,16-18H,4-9,14-15H2,1-3H3