sodium 4-chloranyl-2-(2-ethoxyethylamino)-5-sulfamoyl-benzenesulfonate

Systemtic Name: sodium 4-chloranyl-2-(2-ethoxyethylamino)-5-sulfamoyl-benzenesulfonate Openeye Name: sodium 4-chloro-2-(2-ethoxyethylamino)-5-sulfamoyl-benzenesulfonate CAS Name: sodium 4-chloro-2-(2-ethoxyethylamino)-5-sulfamoylbenzenesulfonate IUPAC Name: sodium 4-chloro-2-(2-ethoxyethylamino)-5-sulfamoylbenzenesulfonate Traditional Name: sodium 4-chloro-2-(2-ethoxyethylamino)-5-sulfamoyl-besylate Formula: C10H14ClN2NaO6S2 MolecularWeight: 380.80073

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCNC1=CC(=C(C=C1S(=O)(=O)[O-])S(=O)(=O)N)Cl.[Na+]

Isomeric SMILES

CCOCCNC1=CC(=C(C=C1S(=O)(=O)[O-])S(=O)(=O)N)Cl.[Na+]

InChI

InChI=1S/C10H15ClN2O6S2.Na/c1-2-19-4-3-13-8-5-7(11)9(20(12,14)15)6-10(8)21(16,17)18;/h5-6,13H,2-4H2,1H3,(H2,12,14,15)(H,16,17,18);/q;+1/p-1