3-[[(Z)-(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]propanenitrile

Systemtic Name: 3-[[(Z)-(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]propanenitrile Openeye Name: 3-[[(Z)-(5-methoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]propanenitrile CAS Name: 3-[[(Z)-(5-methoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]propanenitrile IUPAC Name: 3-[[(Z)-(5-methoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]propanenitrile Traditional Name: 3-[[(Z)-(6-keto-5-methoxy-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]propionitrile Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O4/c1-18-10-6-9(14(16)17)5-8(11(10)15)7-13-4-2-3-12/h5-7,13H,2,4H2,1H3/b8-7-