sodium 2,4,6-trinitrobenzenesulfonic acid

Systemtic Name: sodium 2,4,6-trinitrobenzenesulfonic acid Openeye Name: sodium 2,4,6-trinitrobenzenesulfonic acid CAS Name: sodium 2,4,6-trinitrobenzenesulfonic acid IUPAC Name: sodium 2,4,6-trinitrobenzenesulfonic acid Traditional Name: sodium 2,4,6-trinitrobesylic acid Formula: C6H3N3NaO9S+ MolecularWeight: 316.15749

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H3N3O9S.Na/c10-7(11)3-1-4(8(12)13)6(19(16,17)18)5(2-3)9(14)15;/h1-2H,(H,16,17,18);/q;+1