(5-butoxy-4-phenyl-pyrimidin-2-yl) 3-methylpentanoate

Systemtic Name: (5-butoxy-4-phenyl-pyrimidin-2-yl) 3-methylpentanoate Openeye Name: (5-butoxy-4-phenyl-pyrimidin-2-yl) 3-methylpentanoate CAS Name: 3-methylpentanoic acid (5-butoxy-4-phenyl-2-pyrimidinyl) ester IUPAC Name: (5-butoxy-4-phenylpyrimidin-2-yl) 3-methylpentanoate Traditional Name: 3-methylvaleric acid (5-butoxy-4-phenyl-pyrimidin-2-yl) ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CN=C(N=C1C2=CC=CC=C2)OC(=O)CC(C)CC

Isomeric SMILES

CCCCOC1=CN=C(N=C1C2=CC=CC=C2)OC(=O)CC(C)CC

InChI

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