(E)-3-azanyl-2-[2-(2-nitropyridin-3-yl)oxyethanoyl]but-2-enenitrile

Systemtic Name: (E)-3-azanyl-2-[2-(2-nitropyridin-3-yl)oxyethanoyl]but-2-enenitrile Openeye Name: (E)-3-amino-2-[2-[(2-nitro-3-pyridyl)oxy]acetyl]but-2-enenitrile CAS Name: (E)-3-amino-2-[2-[(2-nitro-3-pyridinyl)oxy]-1-oxoethyl]-2-butenenitrile IUPAC Name: (E)-3-amino-2-[2-(2-nitropyridin-3-yl)oxyacetyl]but-2-enenitrile Traditional Name: (E)-3-amino-2-[2-[(2-nitro-3-pyridyl)oxy]acetyl]but-2-enenitrile Formula: C11H10N4O4 MolecularWeight: 262.2215

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N4O4/c1-7(13)8(5-12)9(16)6-19-10-3-2-4-14-11(10)15(17)18/h2-4H,6,13H2,1H3/b8-7+