[4-(5-octoxypyrimidin-2-yl)phenyl] 2-pentoxypropanoate

Systemtic Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 2-pentoxypropanoate Openeye Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 2-pentoxypropanoate CAS Name: 2-pentoxypropanoic acid [4-(5-octoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 2-pentoxypropanoate Traditional Name: 2-amoxypropionic acid [4-(5-octoxypyrimidin-2-yl)phenyl] ester Formula: C26H38N2O4 MolecularWeight: 442.59092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H38N2O4/c1-4-6-8-9-10-12-18-31-24-19-27-25(28-20-24)22-13-15-23(16-14-22)32-26(29)21(3)30-17-11-7-5-2/h13-16,19-21H,4-12,17-18H2,1-3H3