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

Systemtic Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 3-methoxypropanoate Openeye Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 3-methoxypropanoate CAS Name: 3-methoxypropanoic acid [4-(5-heptoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-heptoxypyrimidin-2-yl)phenyl] 3-methoxypropanoate Traditional Name: 3-methoxypropionic acid [4-(5-heptoxypyrimidin-2-yl)phenyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O4/c1-3-4-5-6-7-13-26-19-15-22-21(23-16-19)17-8-10-18(11-9-17)27-20(24)12-14-25-2/h8-11,15-16H,3-7,12-14H2,1-2H3