(2-phenylpyrimidin-5-yl) 3,3-dimethylbutanoate

Systemtic Name: (2-phenylpyrimidin-5-yl) 3,3-dimethylbutanoate Openeye Name: (2-phenylpyrimidin-5-yl) 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid (2-phenyl-5-pyrimidinyl) ester IUPAC Name: (2-phenylpyrimidin-5-yl) 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid (2-phenylpyrimidin-5-yl) ester Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=CN=C(N=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)CC(=O)OC1=CN=C(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H18N2O2/c1-16(2,3)9-14(19)20-13-10-17-15(18-11-13)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3