2-(3,4-dimethoxy-2,6-dinitro-phenyl)ethanenitrile

Systemtic Name: 2-(3,4-dimethoxy-2,6-dinitro-phenyl)ethanenitrile Openeye Name: 2-(3,4-dimethoxy-2,6-dinitro-phenyl)acetonitrile CAS Name: 2-(3,4-dimethoxy-2,6-dinitrophenyl)acetonitrile IUPAC Name: 2-(3,4-dimethoxy-2,6-dinitrophenyl)acetonitrile Traditional Name: 2-(3,4-dimethoxy-2,6-dinitro-phenyl)acetonitrile Formula: C10H9N3O6 MolecularWeight: 267.19496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9N3O6/c1-18-8-5-7(12(14)15)6(3-4-11)9(13(16)17)10(8)19-2/h5H,3H2,1-2H3