[2-(4-heptylphenyl)pyrimidin-5-yl] undecanoate

Systemtic Name: [2-(4-heptylphenyl)pyrimidin-5-yl] undecanoate Openeye Name: [2-(4-heptylphenyl)pyrimidin-5-yl] undecanoate CAS Name: undecanoic acid [2-(4-heptylphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-heptylphenyl)pyrimidin-5-yl] undecanoate Traditional Name: undecanoic acid [2-(4-heptylphenyl)pyrimidin-5-yl] ester Formula: C28H42N2O2 MolecularWeight: 438.64528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCC

Isomeric SMILES

CCCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCC

InChI

InChI=1S/C28H42N2O2/c1-3-5-7-9-10-11-13-15-17-27(31)32-26-22-29-28(30-23-26)25-20-18-24(19-21-25)16-14-12-8-6-4-2/h18-23H,3-17H2,1-2H3