[4-(5-decoxypyrimidin-2-yl)phenyl] 2-methylbutanoate

Systemtic Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 2-methylbutanoate Openeye Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [4-(5-decoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-decoxypyrimidin-2-yl)phenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [4-(5-decoxypyrimidin-2-yl)phenyl] ester Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36N2O3/c1-4-6-7-8-9-10-11-12-17-29-23-18-26-24(27-19-23)21-13-15-22(16-14-21)30-25(28)20(3)5-2/h13-16,18-20H,4-12,17H2,1-3H3