[4-(5-heptoxypyrimidin-2-yl)phenyl] 3-butoxypropanoate

Systemtic Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 3-butoxypropanoate Openeye Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 3-butoxypropanoate CAS Name: 3-butoxypropanoic acid [4-(5-heptoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 3-butoxypropanoate Traditional Name: 3-butoxypropionic acid [4-(5-heptoxypyrimidin-2-yl)phenyl] ester Formula: C24H34N2O4 MolecularWeight: 414.53776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOCCCC

Isomeric SMILES

CCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOCCCC

InChI

InChI=1S/C24H34N2O4/c1-3-5-7-8-9-16-29-22-18-25-24(26-19-22)20-10-12-21(13-11-20)30-23(27)14-17-28-15-6-4-2/h10-13,18-19H,3-9,14-17H2,1-2H3