[4-(5-pentylpyrimidin-2-yl)phenyl] 2-butoxypropanoate

Systemtic Name: [4-(5-pentylpyrimidin-2-yl)phenyl] 2-butoxypropanoate Openeye Name: [4-(5-pentylpyrimidin-2-yl)phenyl] 2-butoxypropanoate CAS Name: 2-butoxypropanoic acid [4-(5-pentyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-pentylpyrimidin-2-yl)phenyl] 2-butoxypropanoate Traditional Name: 2-butoxypropionic acid [4-(5-amylpyrimidin-2-yl)phenyl] ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O3/c1-4-6-8-9-18-15-23-21(24-16-18)19-10-12-20(13-11-19)27-22(25)17(3)26-14-7-5-2/h10-13,15-17H,4-9,14H2,1-3H3