[4-(5-octoxypyrimidin-2-yl)phenyl] 7-cyclopropylheptanoate

Systemtic Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 7-cyclopropylheptanoate Openeye Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 7-cyclopropylheptanoate CAS Name: 7-cyclopropylheptanoic acid [4-(5-octoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 7-cyclopropylheptanoate Traditional Name: 7-cyclopropylenanthic acid [4-(5-octoxypyrimidin-2-yl)phenyl] ester Formula: C28H40N2O3 MolecularWeight: 452.6288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCCCCCC3CC3

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCCCCCC3CC3

InChI

InChI=1S/C28H40N2O3/c1-2-3-4-5-8-11-20-32-26-21-29-28(30-22-26)24-16-18-25(19-17-24)33-27(31)13-10-7-6-9-12-23-14-15-23/h16-19,21-23H,2-15,20H2,1H3