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

Systemtic Name: [2-(4-heptanoyloxyphenyl)pyrimidin-5-yl] tridecanoate Openeye Name: [2-(4-heptanoyloxyphenyl)pyrimidin-5-yl] tridecanoate CAS Name: tridecanoic acid [2-[4-(1-oxoheptoxy)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-(4-heptanoyloxyphenyl)pyrimidin-5-yl] tridecanoate Traditional Name: tridecanoic acid [2-(4-enanthyloxyphenyl)pyrimidin-5-yl] ester Formula: C30H44N2O4 MolecularWeight: 496.68136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H44N2O4/c1-3-5-7-9-10-11-12-13-14-16-18-29(34)36-27-23-31-30(32-24-27)25-19-21-26(22-20-25)35-28(33)17-15-8-6-4-2/h19-24H,3-18H2,1-2H3