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

Systemtic Name: [4-(5-octylpyrimidin-2-yl)phenyl] 7-cyclopropylheptanoate Openeye Name: [4-(5-octylpyrimidin-2-yl)phenyl] 7-cyclopropylheptanoate CAS Name: 7-cyclopropylheptanoic acid [4-(5-octyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octylpyrimidin-2-yl)phenyl] 7-cyclopropylheptanoate Traditional Name: 7-cyclopropylenanthic acid [4-(5-octylpyrimidin-2-yl)phenyl] ester Formula: C28H40N2O2 MolecularWeight: 436.6294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCCCCCC3CC3

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCCCCCC3CC3

InChI

InChI=1S/C28H40N2O2/c1-2-3-4-5-6-10-13-24-21-29-28(30-22-24)25-17-19-26(20-18-25)32-27(31)14-11-8-7-9-12-23-15-16-23/h17-23H,2-16H2,1H3