2-azanylbenzene-1,4-disulfonic acid; 2-azanylethanesulfonic acid

Systemtic Name: 2-azanylbenzene-1,4-disulfonic acid; 2-azanylethanesulfonic acid Openeye Name: 2-aminobenzene-1,4-disulfonic acid; 2-aminoethanesulfonic acid CAS Name: 2-aminobenzene-1,4-disulfonic acid; 2-aminoethanesulfonic acid IUPAC Name: 2-aminobenzene-1,4-disulfonic acid; 2-aminoethanesulfonic acid Traditional Name: 2-aminobenzene-1,4-disulfonic acid; 2-aminoethanesulfonic acid Formula: C8H14N2O9S3 MolecularWeight: 378.39976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)N)S(=O)(=O)O.C(CS(=O)(=O)O)N

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)N)S(=O)(=O)O.C(CS(=O)(=O)O)N

InChI

InChI=1S/C6H7NO6S2.C2H7NO3S/c7-5-3-4(14(8,9)10)1-2-6(5)15(11,12)13;3-1-2-7(4,5)6/h1-3H,7H2,(H,8,9,10)(H,11,12,13);1-3H2,(H,4,5,6)