[4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] hexanoate

Systemtic Name: [4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] hexanoate Openeye Name: [4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] hexanoate CAS Name: hexanoic acid [4-[2-(4-propylphenyl)-5-pyrimidinyl]phenyl] ester IUPAC Name: [4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] hexanoate Traditional Name: hexanoic acid [4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] ester Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)CCC

Isomeric SMILES

CCCCCC(=O)OC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)CCC

InChI

InChI=1S/C25H28N2O2/c1-3-5-6-8-24(28)29-23-15-13-20(14-16-23)22-17-26-25(27-18-22)21-11-9-19(7-4-2)10-12-21/h9-18H,3-8H2,1-2H3