hexyl 3-[4-(5-propoxypyrimidin-2-yl)phenyl]butanoate

Systemtic Name: hexyl 3-[4-(5-propoxypyrimidin-2-yl)phenyl]butanoate Openeye Name: hexyl 3-[4-(5-propoxypyrimidin-2-yl)phenyl]butanoate CAS Name: 3-[4-(5-propoxy-2-pyrimidinyl)phenyl]butanoic acid hexyl ester IUPAC Name: hexyl 3-[4-(5-propoxypyrimidin-2-yl)phenyl]butanoate Traditional Name: 3-[4-(5-propoxypyrimidin-2-yl)phenyl]butyric acid hexyl ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(C)C1=CC=C(C=C1)C2=NC=C(C=N2)OCCC

Isomeric SMILES

CCCCCCOC(=O)CC(C)C1=CC=C(C=C1)C2=NC=C(C=N2)OCCC

InChI

InChI=1S/C23H32N2O3/c1-4-6-7-8-14-28-22(26)15-18(3)19-9-11-20(12-10-19)23-24-16-21(17-25-23)27-13-5-2/h9-12,16-18H,4-8,13-15H2,1-3H3