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

Systemtic Name: (5-pentoxy-4-phenyl-pyrimidin-2-yl) 4-methylhexanoate Openeye Name: (5-pentoxy-4-phenyl-pyrimidin-2-yl) 4-methylhexanoate CAS Name: 4-methylhexanoic acid (5-pentoxy-4-phenyl-2-pyrimidinyl) ester IUPAC Name: (5-pentoxy-4-phenylpyrimidin-2-yl) 4-methylhexanoate Traditional Name: 4-methylhexanoic acid (5-amoxy-4-phenyl-pyrimidin-2-yl) ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O3/c1-4-6-10-15-26-19-16-23-22(27-20(25)14-13-17(3)5-2)24-21(19)18-11-8-7-9-12-18/h7-9,11-12,16-17H,4-6,10,13-15H2,1-3H3