[(E)-1-azanyl-3-ethoxy-2-nitro-3-oxidanylidene-prop-1-enyl]-(6-chloranylpyridin-3-yl)-dimethyl-azanium

Systemtic Name: [(E)-1-azanyl-3-ethoxy-2-nitro-3-oxidanylidene-prop-1-enyl]-(6-chloranylpyridin-3-yl)-dimethyl-azanium Openeye Name: [(E)-1-amino-3-ethoxy-2-nitro-3-oxo-prop-1-enyl]-(6-chloro-3-pyridyl)-dimethyl-ammonium CAS Name: [(E)-1-amino-3-ethoxy-2-nitro-3-oxoprop-1-enyl]-(6-chloro-3-pyridinyl)-dimethylammonium IUPAC Name: [(E)-1-amino-3-ethoxy-2-nitro-3-oxoprop-1-enyl]-(6-chloropyridin-3-yl)-dimethylazanium Traditional Name: [(E)-1-amino-3-ethoxy-3-keto-2-nitro-prop-1-enyl]-(6-chloro-3-pyridyl)-dimethyl-ammonium Formula: C12H16ClN4O4+ MolecularWeight: 315.73284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(N)[N+](C)(C)C1=CN=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C(=C(/N)\[N+](C)(C)C1=CN=C(C=C1)Cl)/[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN4O4/c1-4-21-12(18)10(16(19)20)11(14)17(2,3)8-5-6-9(13)15-7-8/h5-7H,4H2,1-3H3,(H-,14,18)/p+1