(5-pentoxy-4-phenyl-pyrimidin-2-yl) 2-methylbutanoate

Systemtic Name: (5-pentoxy-4-phenyl-pyrimidin-2-yl) 2-methylbutanoate Openeye Name: (5-pentoxy-4-phenyl-pyrimidin-2-yl) 2-methylbutanoate CAS Name: 2-methylbutanoic acid (5-pentoxy-4-phenyl-2-pyrimidinyl) ester IUPAC Name: (5-pentoxy-4-phenylpyrimidin-2-yl) 2-methylbutanoate Traditional Name: 2-methylbutyric acid (5-amoxy-4-phenyl-pyrimidin-2-yl) ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CN=C(N=C1C2=CC=CC=C2)OC(=O)C(C)CC

Isomeric SMILES

CCCCCOC1=CN=C(N=C1C2=CC=CC=C2)OC(=O)C(C)CC

InChI

InChI=1S/C20H26N2O3/c1-4-6-10-13-24-17-14-21-20(25-19(23)15(3)5-2)22-18(17)16-11-8-7-9-12-16/h7-9,11-12,14-15H,4-6,10,13H2,1-3H3