4-azanyl-3-methylsulfonyl-benzenesulfonic acid

Systemtic Name: 4-azanyl-3-methylsulfonyl-benzenesulfonic acid Openeye Name: 4-amino-3-methylsulfonyl-benzenesulfonic acid CAS Name: 4-amino-3-methylsulfonylbenzenesulfonic acid IUPAC Name: 4-amino-3-methylsulfonylbenzenesulfonic acid Traditional Name: 4-amino-3-mesyl-besylic acid Formula: C7H9NO5S2 MolecularWeight: 251.28006

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)S(=O)(=O)O)N

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)S(=O)(=O)O)N

InChI

InChI=1S/C7H9NO5S2/c1-14(9,10)7-4-5(15(11,12)13)2-3-6(7)8/h2-4H,8H2,1H3,(H,11,12,13)