[2-(4-nonoxyphenyl)pyrimidin-5-yl] decanoate

Systemtic Name: [2-(4-nonoxyphenyl)pyrimidin-5-yl] decanoate Openeye Name: [2-(4-nonoxyphenyl)pyrimidin-5-yl] decanoate CAS Name: decanoic acid [2-(4-nonoxyphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-nonoxyphenyl)pyrimidin-5-yl] decanoate Traditional Name: capric acid [2-(4-nonoxyphenyl)pyrimidin-5-yl] ester Formula: C29H44N2O3 MolecularWeight: 468.67126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCCCCC

InChI

InChI=1S/C29H44N2O3/c1-3-5-7-9-11-13-15-17-28(32)34-27-23-30-29(31-24-27)25-18-20-26(21-19-25)33-22-16-14-12-10-8-6-4-2/h18-21,23-24H,3-17,22H2,1-2H3