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

Systemtic Name: [2-(4-heptylphenyl)pyrimidin-5-yl] 8-methyldecanoate Openeye Name: [2-(4-heptylphenyl)pyrimidin-5-yl] 8-methyldecanoate CAS Name: 8-methyldecanoic acid [2-(4-heptylphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-heptylphenyl)pyrimidin-5-yl] 8-methyldecanoate Traditional Name: 8-methylcapric acid [2-(4-heptylphenyl)pyrimidin-5-yl] ester Formula: C28H42N2O2 MolecularWeight: 438.64528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCC(C)CC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCC(C)CC

InChI

InChI=1S/C28H42N2O2/c1-4-6-7-8-12-15-24-17-19-25(20-18-24)28-29-21-26(22-30-28)32-27(31)16-13-10-9-11-14-23(3)5-2/h17-23H,4-16H2,1-3H3