3-ethanoyl-3-nitro-2,6-dihydro-1H-pyridine-2,6-disulfonic acid

Systemtic Name: 3-ethanoyl-3-nitro-2,6-dihydro-1H-pyridine-2,6-disulfonic acid Openeye Name: 3-acetyl-3-nitro-2,6-dihydro-1H-pyridine-2,6-disulfonic acid CAS Name: 3-acetyl-3-nitro-2,6-dihydro-1H-pyridine-2,6-disulfonic acid IUPAC Name: 3-acetyl-3-nitro-2,6-dihydro-1H-pyridine-2,6-disulfonic acid Traditional Name: 3-acetyl-3-nitro-2,6-dihydro-1H-pyridine-2,6-disulfonic acid Formula: C7H10N2O9S2 MolecularWeight: 330.2923

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C=CC(NC1S(=O)(=O)O)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1(C=CC(NC1S(=O)(=O)O)S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H10N2O9S2/c1-4(10)7(9(11)12)3-2-5(19(13,14)15)8-6(7)20(16,17)18/h2-3,5-6,8H,1H3,(H,13,14,15)(H,16,17,18)