[4-(5-pentylpyrimidin-2-yl)phenyl] 3-ethoxypropanoate

Systemtic Name: [4-(5-pentylpyrimidin-2-yl)phenyl] 3-ethoxypropanoate Openeye Name: [4-(5-pentylpyrimidin-2-yl)phenyl] 3-ethoxypropanoate CAS Name: 3-ethoxypropanoic acid [4-(5-pentyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-pentylpyrimidin-2-yl)phenyl] 3-ethoxypropanoate Traditional Name: 3-ethoxypropionic acid [4-(5-amylpyrimidin-2-yl)phenyl] ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOCC

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOCC

InChI

InChI=1S/C20H26N2O3/c1-3-5-6-7-16-14-21-20(22-15-16)17-8-10-18(11-9-17)25-19(23)12-13-24-4-2/h8-11,14-15H,3-7,12-13H2,1-2H3