2-(3,4-dimethoxy-2-nitro-phenyl)ethanenitrile

Systemtic Name: 2-(3,4-dimethoxy-2-nitro-phenyl)ethanenitrile Openeye Name: 2-(3,4-dimethoxy-2-nitro-phenyl)acetonitrile CAS Name: 2-(3,4-dimethoxy-2-nitrophenyl)acetonitrile IUPAC Name: 2-(3,4-dimethoxy-2-nitrophenyl)acetonitrile Traditional Name: 2-(3,4-dimethoxy-2-nitro-phenyl)acetonitrile Formula: C10H10N2O4 MolecularWeight: 224.189942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC#N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C[14C]#N)[N+](=O)[O-])OC

InChI

InChI=1S/C10H10N2O4/c1-15-8-4-3-7(5-6-11)9(12(13)14)10(8)16-2/h3-4H,5H2,1-2H3/i6+2