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

Systemtic Name: 1-[4-(5-pentoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate Openeye Name: [1-methyl-2-[4-(5-pentoxypyrimidin-2-yl)phenyl]ethyl] butanoate CAS Name: butanoic acid 1-[4-(5-pentoxy-2-pyrimidinyl)phenyl]propan-2-yl ester IUPAC Name: 1-[4-(5-pentoxypyrimidin-2-yl)phenyl]propan-2-yl butanoate Traditional Name: butyric acid [2-[4-(5-amoxypyrimidin-2-yl)phenyl]-1-methyl-ethyl] ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCC

Isomeric SMILES

CCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCC

InChI

InChI=1S/C22H30N2O3/c1-4-6-7-13-26-20-15-23-22(24-16-20)19-11-9-18(10-12-19)14-17(3)27-21(25)8-5-2/h9-12,15-17H,4-8,13-14H2,1-3H3