[4-(5-octoxypyrimidin-2-yl)phenyl] 3-methoxypropanoate

Systemtic Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 3-methoxypropanoate Openeye Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 3-methoxypropanoate CAS Name: 3-methoxypropanoic acid [4-(5-octoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 3-methoxypropanoate Traditional Name: 3-methoxypropionic acid [4-(5-octoxypyrimidin-2-yl)phenyl] ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOC

InChI

InChI=1S/C22H30N2O4/c1-3-4-5-6-7-8-14-27-20-16-23-22(24-17-20)18-9-11-19(12-10-18)28-21(25)13-15-26-2/h9-12,16-17H,3-8,13-15H2,1-2H3