2-(2,6-dimethoxy-5-propan-2-yl-pyrimidin-4-yl)-2-(3-methyl-5-nitro-phenyl)ethanenitrile

Systemtic Name: 2-(2,6-dimethoxy-5-propan-2-yl-pyrimidin-4-yl)-2-(3-methyl-5-nitro-phenyl)ethanenitrile Openeye Name: 2-(5-isopropyl-2,6-dimethoxy-pyrimidin-4-yl)-2-(3-methyl-5-nitro-phenyl)acetonitrile CAS Name: 2-(2,6-dimethoxy-5-propan-2-yl-4-pyrimidinyl)-2-(3-methyl-5-nitrophenyl)acetonitrile IUPAC Name: 2-(2,6-dimethoxy-5-propan-2-ylpyrimidin-4-yl)-2-(3-methyl-5-nitrophenyl)acetonitrile Traditional Name: 2-(5-isopropyl-2,6-dimethoxy-pyrimidin-4-yl)-2-(3-methyl-5-nitro-phenyl)acetonitrile Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)[N+](=O)[O-])C(C#N)C2=C(C(=NC(=N2)OC)OC)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)[N+](=O)[O-])C(C#N)C2=C(C(=NC(=N2)OC)OC)C(C)C

InChI

InChI=1S/C18H20N4O4/c1-10(2)15-16(20-18(26-5)21-17(15)25-4)14(9-19)12-6-11(3)7-13(8-12)22(23)24/h6-8,10,14H,1-5H3