[2-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] 4-methylpentanoate

Systemtic Name: [2-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] 4-methylpentanoate Openeye Name: [2-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] 4-methylpentanoate CAS Name: 4-methylpentanoic acid [2-[5-[octoxy(oxo)methoxy]-2-pyrimidinyl]phenyl] ester IUPAC Name: [2-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] 4-methylpentanoate Traditional Name: 4-methylvaleric acid [2-(5-octoxycarbonyloxypyrimidin-2-yl)phenyl] ester Formula: C25H34N2O5 MolecularWeight: 442.54786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)OC1=CN=C(N=C1)C2=CC=CC=C2OC(=O)CCC(C)C

Isomeric SMILES

CCCCCCCCOC(=O)OC1=CN=C(N=C1)C2=CC=CC=C2OC(=O)CCC(C)C

InChI

InChI=1S/C25H34N2O5/c1-4-5-6-7-8-11-16-30-25(29)31-20-17-26-24(27-18-20)21-12-9-10-13-22(21)32-23(28)15-14-19(2)3/h9-10,12-13,17-19H,4-8,11,14-16H2,1-3H3