[2-(2-fluoranyl-4-heptoxy-phenyl)pyrimidin-5-yl] nonanoate

Systemtic Name: [2-(2-fluoranyl-4-heptoxy-phenyl)pyrimidin-5-yl] nonanoate Openeye Name: [2-(2-fluoro-4-heptoxy-phenyl)pyrimidin-5-yl] nonanoate CAS Name: nonanoic acid [2-(2-fluoro-4-heptoxyphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(2-fluoro-4-heptoxyphenyl)pyrimidin-5-yl] nonanoate Traditional Name: pelargonic acid [2-(2-fluoro-4-heptoxy-phenyl)pyrimidin-5-yl] ester Formula: C26H37FN2O3 MolecularWeight: 444.581983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=CN=C(N=C1)C2=C(C=C(C=C2)OCCCCCCC)F

Isomeric SMILES

CCCCCCCCC(=O)OC1=CN=C(N=C1)C2=C(C=C(C=C2)OCCCCCCC)F

InChI

InChI=1S/C26H37FN2O3/c1-3-5-7-9-10-12-14-25(30)32-22-19-28-26(29-20-22)23-16-15-21(18-24(23)27)31-17-13-11-8-6-4-2/h15-16,18-20H,3-14,17H2,1-2H3