[4-(5-heptylpyrimidin-2-yl)phenyl] 2-pentoxypropanoate

Systemtic Name: [4-(5-heptylpyrimidin-2-yl)phenyl] 2-pentoxypropanoate Openeye Name: [4-(5-heptylpyrimidin-2-yl)phenyl] 2-pentoxypropanoate CAS Name: 2-pentoxypropanoic acid [4-(5-heptyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-heptylpyrimidin-2-yl)phenyl] 2-pentoxypropanoate Traditional Name: 2-amoxypropionic acid [4-(5-heptylpyrimidin-2-yl)phenyl] ester Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)OCCCCC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)OCCCCC

InChI

InChI=1S/C25H36N2O3/c1-4-6-8-9-10-12-21-18-26-24(27-19-21)22-13-15-23(16-14-22)30-25(28)20(3)29-17-11-7-5-2/h13-16,18-20H,4-12,17H2,1-3H3