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

Systemtic Name: 1-[4-(5-hexylpyrimidin-2-yl)phenyl]propan-2-yl butanoate Openeye Name: [2-[4-(5-hexylpyrimidin-2-yl)phenyl]-1-methyl-ethyl] butanoate CAS Name: butanoic acid 1-[4-(5-hexyl-2-pyrimidinyl)phenyl]propan-2-yl ester IUPAC Name: 1-[4-(5-hexylpyrimidin-2-yl)phenyl]propan-2-yl butanoate Traditional Name: butyric acid [2-[4-(5-hexylpyrimidin-2-yl)phenyl]-1-methyl-ethyl] ester Formula: C23H32N2O2 MolecularWeight: 368.51238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCC

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CC(C)OC(=O)CCC

InChI

InChI=1S/C23H32N2O2/c1-4-6-7-8-10-20-16-24-23(25-17-20)21-13-11-19(12-14-21)15-18(3)27-22(26)9-5-2/h11-14,16-18H,4-10,15H2,1-3H3