2-(4,6-dimethoxypyrimidin-2-yl)-2-(2-nitrophenyl)ethanenitrile

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)-2-(2-nitrophenyl)ethanenitrile Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)-2-(2-nitrophenyl)acetonitrile CAS Name: 2-(4,6-dimethoxy-2-pyrimidinyl)-2-(2-nitrophenyl)acetonitrile IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)-2-(2-nitrophenyl)acetonitrile Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)-2-(2-nitrophenyl)acetonitrile Formula: C14H12N4O4 MolecularWeight: 300.26948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C(C#N)C2=CC=CC=C2[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=NC(=N1)C(C#N)C2=CC=CC=C2[N+](=O)[O-])OC

InChI

InChI=1S/C14H12N4O4/c1-21-12-7-13(22-2)17-14(16-12)10(8-15)9-5-3-4-6-11(9)18(19)20/h3-7,10H,1-2H3