sodium 4-acetamido-3-nitro-benzenesulfonate

Systemtic Name: sodium 4-acetamido-3-nitro-benzenesulfonate Openeye Name: sodium 4-acetamido-3-nitro-benzenesulfonate CAS Name: sodium 4-acetamido-3-nitrobenzenesulfonate IUPAC Name: sodium 4-acetamido-3-nitrobenzenesulfonate Traditional Name: sodium 4-acetamido-3-nitro-besylate Formula: C8H7N2NaO6S MolecularWeight: 282.20575

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

InChI

InChI=1S/C8H8N2O6S.Na/c1-5(11)9-7-3-2-6(17(14,15)16)4-8(7)10(12)13;/h2-4H,1H3,(H,9,11)(H,14,15,16);/q;+1/p-1