[4-[2-(4-decylphenyl)pyrimidin-5-yl]phenyl] decanoate

Systemtic Name: [4-[2-(4-decylphenyl)pyrimidin-5-yl]phenyl] decanoate Openeye Name: [4-[2-(4-decylphenyl)pyrimidin-5-yl]phenyl] decanoate CAS Name: decanoic acid [4-[2-(4-decylphenyl)-5-pyrimidinyl]phenyl] ester IUPAC Name: [4-[2-(4-decylphenyl)pyrimidin-5-yl]phenyl] decanoate Traditional Name: capric acid [4-[2-(4-decylphenyl)pyrimidin-5-yl]phenyl] ester Formula: C36H50N2O2 MolecularWeight: 542.7944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCCCCCCCC

InChI

InChI=1S/C36H50N2O2/c1-3-5-7-9-11-13-14-16-18-30-20-22-32(23-21-30)36-37-28-33(29-38-36)31-24-26-34(27-25-31)40-35(39)19-17-15-12-10-8-6-4-2/h20-29H,3-19H2,1-2H3