ethyl 2-[(3-cyano-5-nitro-pyridin-1-ium-2-yl)amino]ethanoate

Systemtic Name: ethyl 2-[(3-cyano-5-nitro-pyridin-1-ium-2-yl)amino]ethanoate Openeye Name: ethyl 2-[(3-cyano-5-nitro-pyridin-1-ium-2-yl)amino]acetate CAS Name: 2-[(3-cyano-5-nitro-2-pyridin-1-iumyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3-cyano-5-nitropyridin-1-ium-2-yl)amino]acetate Traditional Name: 2-[(3-cyano-5-nitro-pyridin-1-ium-2-yl)amino]acetic acid ethyl ester Formula: C10H11N4O4+ MolecularWeight: 251.21874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=[NH+]C=C(C=C1C#N)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CNC1=[NH+]C=C(C=C1C#N)[N+](=O)[O-]

InChI

InChI=1S/C10H10N4O4/c1-2-18-9(15)6-13-10-7(4-11)3-8(5-12-10)14(16)17/h3,5H,2,6H2,1H3,(H,12,13)/p+1