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

Systemtic Name: [4-[2-(4-tetradecoxyphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate Openeye Name: [4-[2-(4-tetradecoxyphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate CAS Name: 8-methyldecanoic acid [4-[2-(4-tetradecoxyphenyl)-5-pyrimidinyl]phenyl] ester IUPAC Name: [4-[2-(4-tetradecoxyphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate Traditional Name: 8-methylcapric acid [4-[2-(4-myristyloxyphenyl)pyrimidin-5-yl]phenyl] ester Formula: C41H60N2O3 MolecularWeight: 628.9267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCCCCCC(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCCCCCC(C)CC

InChI

InChI=1S/C41H60N2O3/c1-4-6-7-8-9-10-11-12-13-14-17-20-31-45-38-27-25-36(26-28-38)41-42-32-37(33-43-41)35-23-29-39(30-24-35)46-40(44)22-19-16-15-18-21-34(3)5-2/h23-30,32-34H,4-22,31H2,1-3H3