[4-(5-hexylpyrimidin-2-yl)phenyl] 2-ethoxypropanoate

Systemtic Name: [4-(5-hexylpyrimidin-2-yl)phenyl] 2-ethoxypropanoate Openeye Name: [4-(5-hexylpyrimidin-2-yl)phenyl] 2-ethoxypropanoate CAS Name: 2-ethoxypropanoic acid [4-(5-hexyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-hexylpyrimidin-2-yl)phenyl] 2-ethoxypropanoate Traditional Name: 2-ethoxypropionic acid [4-(5-hexylpyrimidin-2-yl)phenyl] ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)OCC

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)OCC

InChI

InChI=1S/C21H28N2O3/c1-4-6-7-8-9-17-14-22-20(23-15-17)18-10-12-19(13-11-18)26-21(24)16(3)25-5-2/h10-16H,4-9H2,1-3H3