[2-(4-pentylphenyl)pyrimidin-5-yl] 2-methylbutanoate

Systemtic Name: [2-(4-pentylphenyl)pyrimidin-5-yl] 2-methylbutanoate Openeye Name: [2-(4-pentylphenyl)pyrimidin-5-yl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-(4-pentylphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-pentylphenyl)pyrimidin-5-yl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-(4-amylphenyl)pyrimidin-5-yl] ester Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)C(C)CC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)C(C)CC

InChI

InChI=1S/C20H26N2O2/c1-4-6-7-8-16-9-11-17(12-10-16)19-21-13-18(14-22-19)24-20(23)15(3)5-2/h9-15H,4-8H2,1-3H3