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

Systemtic Name: [4-(5-octylpyrimidin-2-yl)phenyl] 3-methoxypropanoate Openeye Name: [4-(5-octylpyrimidin-2-yl)phenyl] 3-methoxypropanoate CAS Name: 3-methoxypropanoic acid [4-(5-octyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octylpyrimidin-2-yl)phenyl] 3-methoxypropanoate Traditional Name: 3-methoxypropionic acid [4-(5-octylpyrimidin-2-yl)phenyl] ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOC

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOC

InChI

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