4-(2-sulfoethylamino)benzenesulfonic acid

Systemtic Name: 4-(2-sulfoethylamino)benzenesulfonic acid Openeye Name: 4-(2-sulfoethylamino)benzenesulfonic acid CAS Name: 4-(2-sulfoethylamino)benzenesulfonic acid IUPAC Name: 4-(2-sulfoethylamino)benzenesulfonic acid Traditional Name: 4-(2-sulfoethylamino)besylic acid Formula: C8H11NO6S2 MolecularWeight: 281.30604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCS(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NCCS(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H11NO6S2/c10-16(11,12)6-5-9-7-1-3-8(4-2-7)17(13,14)15/h1-4,9H,5-6H2,(H,10,11,12)(H,13,14,15)