[4-(5-hexoxypyrimidin-2-yl)phenyl] 3-heptoxypropanoate

Systemtic Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-heptoxypropanoate Openeye Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-heptoxypropanoate CAS Name: 3-heptoxypropanoic acid [4-(5-hexoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-heptoxypropanoate Traditional Name: 3-heptoxypropionic acid [4-(5-hexoxypyrimidin-2-yl)phenyl] ester Formula: C26H38N2O4 MolecularWeight: 442.59092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCC

Isomeric SMILES

CCCCCCCOCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCC

InChI

InChI=1S/C26H38N2O4/c1-3-5-7-9-10-17-30-19-16-25(29)32-23-14-12-22(13-15-23)26-27-20-24(21-28-26)31-18-11-8-6-4-2/h12-15,20-21H,3-11,16-19H2,1-2H3