[4-(5-decoxypyrimidin-2-yl)phenyl] 3-methylpentanoate

Systemtic Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 3-methylpentanoate Openeye Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 3-methylpentanoate CAS Name: 3-methylpentanoic acid [4-(5-decoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 3-methylpentanoate Traditional Name: 3-methylvaleric acid [4-(5-decoxypyrimidin-2-yl)phenyl] ester Formula: C26H38N2O3 MolecularWeight: 426.59152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CC(C)CC

Isomeric SMILES

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CC(C)CC

InChI

InChI=1S/C26H38N2O3/c1-4-6-7-8-9-10-11-12-17-30-24-19-27-26(28-20-24)22-13-15-23(16-14-22)31-25(29)18-21(3)5-2/h13-16,19-21H,4-12,17-18H2,1-3H3