[4-(5-butoxypyrimidin-2-yl)phenyl] 2-heptoxypropanoate

Systemtic Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 2-heptoxypropanoate Openeye Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 2-heptoxypropanoate CAS Name: 2-heptoxypropanoic acid [4-(5-butoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-butoxypyrimidin-2-yl)phenyl] 2-heptoxypropanoate Traditional Name: 2-heptoxypropionic acid [4-(5-butoxypyrimidin-2-yl)phenyl] ester Formula: C24H34N2O4 MolecularWeight: 414.53776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(C)C(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCC

Isomeric SMILES

CCCCCCCOC(C)C(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCC

InChI

InChI=1S/C24H34N2O4/c1-4-6-8-9-10-16-28-19(3)24(27)30-21-13-11-20(12-14-21)23-25-17-22(18-26-23)29-15-7-5-2/h11-14,17-19H,4-10,15-16H2,1-3H3