5-ethyl-2-methyl-4-nitro-1-oxidanidyl-pyridin-1-ium hydrate

Systemtic Name: 5-ethyl-2-methyl-4-nitro-1-oxidanidyl-pyridin-1-ium hydrate Openeye Name: 5-ethyl-2-methyl-4-nitro-1-oxido-pyridin-1-ium hydrate CAS Name: 5-ethyl-2-methyl-4-nitro-1-oxidopyridin-1-ium hydrate IUPAC Name: 5-ethyl-2-methyl-4-nitro-1-oxidopyridin-1-ium hydrate Traditional Name: 5-ethyl-2-methyl-4-nitro-1-oxido-pyridin-1-ium hydrate Formula: C8H12N2O4 MolecularWeight: 200.19188

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=C(C=C1[N+](=O)[O-])C)[O-].O

Isomeric SMILES

CCC1=C[N+](=C(C=C1[N+](=O)[O-])C)[O-].O

InChI

InChI=1S/C8H10N2O3.H2O/c1-3-7-5-9(11)6(2)4-8(7)10(12)13;/h4-5H,3H2,1-2H3;1H2