ethyl 2-(1-oxidanidylpyridin-1-ium-3-yl)ethanoate; 4-methyl-3-nitro-1-(4-nitrophenyl)-2-oxidanidyl-pyrazol-2-ium

Systemtic Name: ethyl 2-(1-oxidanidylpyridin-1-ium-3-yl)ethanoate; 4-methyl-3-nitro-1-(4-nitrophenyl)-2-oxidanidyl-pyrazol-2-ium Openeye Name: ethyl 2-(1-oxidopyridin-1-ium-3-yl)acetate; 4-methyl-3-nitro-1-(4-nitrophenyl)-2-oxido-pyrazol-2-ium CAS Name: 4-methyl-3-nitro-1-(4-nitrophenyl)-2-oxidopyrazol-2-ium; 2-(1-oxido-3-pyridin-1-iumyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(1-oxidopyridin-1-ium-3-yl)acetate; 4-methyl-3-nitro-1-(4-nitrophenyl)-2-oxidopyrazol-2-ium Traditional Name: 4-methyl-3-nitro-1-(4-nitrophenyl)-2-oxido-pyrazol-2-ium; 2-(1-oxidopyridin-1-ium-3-yl)acetic acid ethyl ester Formula: C19H19N5O8 MolecularWeight: 445.38286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C[N+](=CC=C1)[O-].CC1=CN([N+](=C1[N+](=O)[O-])[O-])C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=C[N+](=CC=C1)[O-].CC1=CN([N+](=C1[N+](=O)[O-])[O-])C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H8N4O5.C9H11NO3/c1-7-6-11(12(15)10(7)14(18)19)8-2-4-9(5-3-8)13(16)17;1-2-13-9(11)6-8-4-3-5-10(12)7-8/h2-6H,1H3;3-5,7H,2,6H2,1H3