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

Systemtic Name: [2-(4-nonanoyloxyphenyl)pyrimidin-5-yl] tridecanoate Openeye Name: [2-(4-nonanoyloxyphenyl)pyrimidin-5-yl] tridecanoate CAS Name: tridecanoic acid [2-[4-(1-oxononoxy)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-(4-nonanoyloxyphenyl)pyrimidin-5-yl] tridecanoate Traditional Name: tridecanoic acid [2-(4-pelargonyloxyphenyl)pyrimidin-5-yl] ester Formula: C32H48N2O4 MolecularWeight: 524.73452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H48N2O4/c1-3-5-7-9-11-12-13-14-16-18-20-31(36)38-29-25-33-32(34-26-29)27-21-23-28(24-22-27)37-30(35)19-17-15-10-8-6-4-2/h21-26H,3-20H2,1-2H3