sodium 2-(2-ethoxyethoxy)-5-nitro-benzenesulfonate

Systemtic Name: sodium 2-(2-ethoxyethoxy)-5-nitro-benzenesulfonate Openeye Name: sodium 2-(2-ethoxyethoxy)-5-nitro-benzenesulfonate CAS Name: sodium 2-(2-ethoxyethoxy)-5-nitrobenzenesulfonate IUPAC Name: sodium 2-(2-ethoxyethoxy)-5-nitrobenzenesulfonate Traditional Name: sodium 2-(2-ethoxyethoxy)-5-nitro-besylate Formula: C10H12NNaO7S MolecularWeight: 313.25955

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCOCCOC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H13NO7S.Na/c1-2-17-5-6-18-9-4-3-8(11(12)13)7-10(9)19(14,15)16;/h3-4,7H,2,5-6H2,1H3,(H,14,15,16);/q;+1/p-1