[2-(4-undecylphenyl)pyrimidin-5-yl] 8-methyldecanoate

Systemtic Name: [2-(4-undecylphenyl)pyrimidin-5-yl] 8-methyldecanoate Openeye Name: [2-(4-undecylphenyl)pyrimidin-5-yl] 8-methyldecanoate CAS Name: 8-methyldecanoic acid [2-(4-undecylphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-undecylphenyl)pyrimidin-5-yl] 8-methyldecanoate Traditional Name: 8-methylcapric acid [2-(4-undecylphenyl)pyrimidin-5-yl] ester Formula: C32H50N2O2 MolecularWeight: 494.7516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCC(C)CC

Isomeric SMILES

CCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCC(C)CC

InChI

InChI=1S/C32H50N2O2/c1-4-6-7-8-9-10-11-12-16-19-28-21-23-29(24-22-28)32-33-25-30(26-34-32)36-31(35)20-17-14-13-15-18-27(3)5-2/h21-27H,4-20H2,1-3H3