[4-(5-butoxypyrimidin-2-yl)phenyl] 4-methylhexanoate

Systemtic Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 4-methylhexanoate Openeye Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 4-methylhexanoate CAS Name: 4-methylhexanoic acid [4-(5-butoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 4-methylhexanoate Traditional Name: 4-methylhexanoic acid [4-(5-butoxypyrimidin-2-yl)phenyl] ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCC(C)CC

Isomeric SMILES

CCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCC(C)CC

InChI

InChI=1S/C21H28N2O3/c1-4-6-13-25-19-14-22-21(23-15-19)17-8-10-18(11-9-17)26-20(24)12-7-16(3)5-2/h8-11,14-16H,4-7,12-13H2,1-3H3