[4-(5-butylpyrimidin-2-yl)phenyl] 3-hexoxypropanoate

Systemtic Name: [4-(5-butylpyrimidin-2-yl)phenyl] 3-hexoxypropanoate Openeye Name: [4-(5-butylpyrimidin-2-yl)phenyl] 3-hexoxypropanoate CAS Name: 3-hexoxypropanoic acid [4-(5-butyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-butylpyrimidin-2-yl)phenyl] 3-hexoxypropanoate Traditional Name: 3-hexoxypropionic acid [4-(5-butylpyrimidin-2-yl)phenyl] ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCC

Isomeric SMILES

CCCCCCOCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCC

InChI

InChI=1S/C23H32N2O3/c1-3-5-7-8-15-27-16-14-22(26)28-21-12-10-20(11-13-21)23-24-17-19(18-25-23)9-6-4-2/h10-13,17-18H,3-9,14-16H2,1-2H3