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

Systemtic Name: [4-[2-(4-tetradecylphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate Openeye Name: [4-[2-(4-tetradecylphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate CAS Name: 8-methyldecanoic acid [4-[2-(4-tetradecylphenyl)-5-pyrimidinyl]phenyl] ester IUPAC Name: [4-[2-(4-tetradecylphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate Traditional Name: 8-methylcapric acid [4-[2-(4-myristylphenyl)pyrimidin-5-yl]phenyl] ester Formula: C41H60N2O2 MolecularWeight: 612.9273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCCCCCC(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCCCCCC(C)CC

InChI

InChI=1S/C41H60N2O2/c1-4-6-7-8-9-10-11-12-13-14-15-19-22-35-24-26-37(27-25-35)41-42-32-38(33-43-41)36-28-30-39(31-29-36)45-40(44)23-20-17-16-18-21-34(3)5-2/h24-34H,4-23H2,1-3H3