[2-(4-decylpyrimidin-2-yl)phenyl] 2-methylbutanoate

Systemtic Name: [2-(4-decylpyrimidin-2-yl)phenyl] 2-methylbutanoate Openeye Name: [2-(4-decylpyrimidin-2-yl)phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-(4-decyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [2-(4-decylpyrimidin-2-yl)phenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-(4-decylpyrimidin-2-yl)phenyl] ester Formula: C25H36N2O2 MolecularWeight: 396.56554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OC(=O)C(C)CC

Isomeric SMILES

CCCCCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OC(=O)C(C)CC

InChI

InChI=1S/C25H36N2O2/c1-4-6-7-8-9-10-11-12-15-21-18-19-26-24(27-21)22-16-13-14-17-23(22)29-25(28)20(3)5-2/h13-14,16-20H,4-12,15H2,1-3H3