2-[(4-azido-2-nitro-phenyl)amino]ethanesulfonic acid; sodium

Systemtic Name: 2-[(4-azido-2-nitro-phenyl)amino]ethanesulfonic acid; sodium Openeye Name: 2-(4-azido-2-nitro-anilino)ethanesulfonic acid; sodium CAS Name: 2-(4-azido-2-nitroanilino)ethanesulfonic acid; sodium IUPAC Name: 2-(4-azido-2-nitroanilino)ethanesulfonic acid; sodium Traditional Name: 2-(4-azido-2-nitro-anilino)ethanesulfonic acid; sodium Formula: C8H9N5NaO5S MolecularWeight: 310.24233

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])NCCS(=O)(=O)O.[Na]

Isomeric SMILES

C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])NCCS(=O)(=O)O.[Na]

InChI

InChI=1S/C8H9N5O5S.Na/c9-12-11-6-1-2-7(8(5-6)13(14)15)10-3-4-19(16,17)18;/h1-2,5,10H,3-4H2,(H,16,17,18);