[2-(4-nonylphenyl)pyrimidin-5-yl] tridecanoate

Systemtic Name: [2-(4-nonylphenyl)pyrimidin-5-yl] tridecanoate Openeye Name: [2-(4-nonylphenyl)pyrimidin-5-yl] tridecanoate CAS Name: tridecanoic acid [2-(4-nonylphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-nonylphenyl)pyrimidin-5-yl] tridecanoate Traditional Name: tridecanoic acid [2-(4-nonylphenyl)pyrimidin-5-yl] ester Formula: C32H50N2O2 MolecularWeight: 494.7516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCCCCCC

InChI

InChI=1S/C32H50N2O2/c1-3-5-7-9-11-12-13-15-17-19-21-31(35)36-30-26-33-32(34-27-30)29-24-22-28(23-25-29)20-18-16-14-10-8-6-4-2/h22-27H,3-21H2,1-2H3