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

Systemtic Name: [2-(4-nonylphenyl)pyrimidin-5-yl] 2-methylbutanoate Openeye Name: [2-(4-nonylphenyl)pyrimidin-5-yl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-(4-nonylphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-nonylphenyl)pyrimidin-5-yl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-(4-nonylphenyl)pyrimidin-5-yl] ester Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)C(C)CC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)C(C)CC

InChI

InChI=1S/C24H34N2O2/c1-4-6-7-8-9-10-11-12-20-13-15-21(16-14-20)23-25-17-22(18-26-23)28-24(27)19(3)5-2/h13-19H,4-12H2,1-3H3