[4-(5-nonoxypyrimidin-2-yl)phenyl] 2-octoxypropanoate

Systemtic Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 2-octoxypropanoate Openeye Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 2-octoxypropanoate CAS Name: 2-octoxypropanoic acid [4-(5-nonoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 2-octoxypropanoate Traditional Name: 2-octoxypropionic acid [4-(5-nonoxypyrimidin-2-yl)phenyl] ester Formula: C30H46N2O4 MolecularWeight: 498.69724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)OCCCCCCCC

InChI

InChI=1S/C30H46N2O4/c1-4-6-8-10-12-14-16-22-35-28-23-31-29(32-24-28)26-17-19-27(20-18-26)36-30(33)25(3)34-21-15-13-11-9-7-5-2/h17-20,23-25H,4-16,21-22H2,1-3H3