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

Systemtic Name: [4-[2-(4-heptylphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate Openeye Name: [4-[2-(4-heptylphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate CAS Name: 8-methyldecanoic acid [4-[2-(4-heptylphenyl)-5-pyrimidinyl]phenyl] ester IUPAC Name: [4-[2-(4-heptylphenyl)pyrimidin-5-yl]phenyl] 8-methyldecanoate Traditional Name: 8-methylcapric acid [4-[2-(4-heptylphenyl)pyrimidin-5-yl]phenyl] ester Formula: C34H46N2O2 MolecularWeight: 514.74124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCCCCCC(C)CC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(=O)CCCCCCC(C)CC

InChI

InChI=1S/C34H46N2O2/c1-4-6-7-8-12-15-28-17-19-30(20-18-28)34-35-25-31(26-36-34)29-21-23-32(24-22-29)38-33(37)16-13-10-9-11-14-27(3)5-2/h17-27H,4-16H2,1-3H3