3-[bis(2-azanyl-1-oxidanyl-2-oxidanylidene-ethyl)amino]benzenesulfonic acid

Systemtic Name: 3-[bis(2-azanyl-1-oxidanyl-2-oxidanylidene-ethyl)amino]benzenesulfonic acid Openeye Name: 3-[bis(2-amino-1-hydroxy-2-oxo-ethyl)amino]benzenesulfonic acid CAS Name: 3-[bis(2-amino-1-hydroxy-2-oxoethyl)amino]benzenesulfonic acid IUPAC Name: 3-[bis(2-amino-1-hydroxy-2-oxoethyl)amino]benzenesulfonic acid Traditional Name: 3-[bis(2-amino-1-hydroxy-2-keto-ethyl)amino]besylic acid Formula: C10H13N3O7S MolecularWeight: 319.29112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O7S/c11-7(14)9(16)13(10(17)8(12)15)5-2-1-3-6(4-5)21(18,19)20/h1-4,9-10,16-17H,(H2,11,14)(H2,12,15)(H,18,19,20)