(2S)-2-(3-methylphenyl)-2-pyrimidin-2-yl-ethanoate

Systemtic Name: (2S)-2-(3-methylphenyl)-2-pyrimidin-2-yl-ethanoate Openeye Name: (2S)-2-(m-tolyl)-2-pyrimidin-2-yl-acetate CAS Name: (2S)-2-(3-methylphenyl)-2-(2-pyrimidinyl)acetate IUPAC Name: (2S)-2-(3-methylphenyl)-2-pyrimidin-2-ylacetate Traditional Name: (2S)-2-(m-tolyl)-2-(2-pyrimidyl)acetate Formula: C13H11N2O2- MolecularWeight: 227.23864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=NC=CC=N2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)[C@@H](C2=NC=CC=N2)C(=O)[O-]

InChI

InChI=1S/C13H12N2O2/c1-9-4-2-5-10(8-9)11(13(16)17)12-14-6-3-7-15-12/h2-8,11H,1H3,(H,16,17)/p-1/t11-/m0/s1