2-(3,4-dimethoxy-2,5-dinitro-phenyl)ethanenitrile

Systemtic Name: 2-(3,4-dimethoxy-2,5-dinitro-phenyl)ethanenitrile Openeye Name: 2-(3,4-dimethoxy-2,5-dinitro-phenyl)acetonitrile CAS Name: 2-(3,4-dimethoxy-2,5-dinitrophenyl)acetonitrile IUPAC Name: 2-(3,4-dimethoxy-2,5-dinitrophenyl)acetonitrile Traditional Name: 2-(3,4-dimethoxy-2,5-dinitro-phenyl)acetonitrile Formula: C10H9N3O6 MolecularWeight: 267.19496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1OC)[N+](=O)[O-])CC#N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C(=C1OC)[N+](=O)[O-])CC#N)[N+](=O)[O-]

InChI

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