[4-(5-heptylpyrimidin-2-yl)phenyl] 2-methylpentanoate

Systemtic Name: [4-(5-heptylpyrimidin-2-yl)phenyl] 2-methylpentanoate Openeye Name: [4-(5-heptylpyrimidin-2-yl)phenyl] 2-methylpentanoate CAS Name: 2-methylpentanoic acid [4-(5-heptyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-heptylpyrimidin-2-yl)phenyl] 2-methylpentanoate Traditional Name: 2-methylvaleric acid [4-(5-heptylpyrimidin-2-yl)phenyl] ester Formula: C23H32N2O2 MolecularWeight: 368.51238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)CCC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)CCC

InChI

InChI=1S/C23H32N2O2/c1-4-6-7-8-9-11-19-16-24-22(25-17-19)20-12-14-21(15-13-20)27-23(26)18(3)10-5-2/h12-18H,4-11H2,1-3H3