2-[methyl-[2-(phenylsulfonyl)-5-sulfamoyl-phenyl]amino]ethanesulfonic acid

Systemtic Name: 2-[methyl-[2-(phenylsulfonyl)-5-sulfamoyl-phenyl]amino]ethanesulfonic acid Openeye Name: 2-[2-(benzenesulfonyl)-N-methyl-5-sulfamoyl-anilino]ethanesulfonic acid CAS Name: 2-[2-(benzenesulfonyl)-N-methyl-5-sulfamoylanilino]ethanesulfonic acid IUPAC Name: 2-[2-(benzenesulfonyl)-N-methyl-5-sulfamoylanilino]ethanesulfonic acid Traditional Name: 2-(2-besyl-N-methyl-5-sulfamoyl-anilino)ethanesulfonic acid Formula: C15H18N2O7S3 MolecularWeight: 434.50762

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCS(=O)(=O)O)C1=C(C=CC(=C1)S(=O)(=O)N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CN(CCS(=O)(=O)O)C1=C(C=CC(=C1)S(=O)(=O)N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H18N2O7S3/c1-17(9-10-25(18,19)20)14-11-13(27(16,23)24)7-8-15(14)26(21,22)12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3,(H2,16,23,24)(H,18,19,20)