2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]ethanesulfonic acid

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]ethanesulfonic acid Openeye Name: 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]ethanesulfonic acid CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonylamino]ethanesulfonic acid IUPAC Name: 2-[(4-chloro-3-nitrophenyl)sulfonylamino]ethanesulfonic acid Traditional Name: 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]ethanesulfonic acid Formula: C8H9ClN2O7S2 MolecularWeight: 344.74926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCCS(=O)(=O)O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCCS(=O)(=O)O)[N+](=O)[O-])Cl

InChI

InChI=1S/C8H9ClN2O7S2/c9-7-2-1-6(5-8(7)11(12)13)20(17,18)10-3-4-19(14,15)16/h1-2,5,10H,3-4H2,(H,14,15,16)