[2-(4-heptoxyphenyl)pyrimidin-5-yl] hexanoate

Systemtic Name: [2-(4-heptoxyphenyl)pyrimidin-5-yl] hexanoate Openeye Name: [2-(4-heptoxyphenyl)pyrimidin-5-yl] hexanoate CAS Name: hexanoic acid [2-(4-heptoxyphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-heptoxyphenyl)pyrimidin-5-yl] hexanoate Traditional Name: hexanoic acid [2-(4-heptoxyphenyl)pyrimidin-5-yl] ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCC

InChI

InChI=1S/C23H32N2O3/c1-3-5-7-8-10-16-27-20-14-12-19(13-15-20)23-24-17-21(18-25-23)28-22(26)11-9-6-4-2/h12-15,17-18H,3-11,16H2,1-2H3