sodium 5-azanyl-2-(2-methoxyethoxy)benzenesulfonate

Systemtic Name: sodium 5-azanyl-2-(2-methoxyethoxy)benzenesulfonate Openeye Name: sodium 5-amino-2-(2-methoxyethoxy)benzenesulfonate CAS Name: sodium 5-amino-2-(2-methoxyethoxy)benzenesulfonate IUPAC Name: sodium 5-amino-2-(2-methoxyethoxy)benzenesulfonate Traditional Name: sodium 5-amino-2-(2-methoxyethoxy)besylate Formula: C9H12NNaO5S MolecularWeight: 269.25005

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)N)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

COCCOC1=C(C=C(C=C1)N)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C9H13NO5S.Na/c1-14-4-5-15-8-3-2-7(10)6-9(8)16(11,12)13;/h2-3,6H,4-5,10H2,1H3,(H,11,12,13);/q;+1/p-1