5-acetamido-4-oxidanyl-naphthalene-1,2-disulfonic acid

Systemtic Name: 5-acetamido-4-oxidanyl-naphthalene-1,2-disulfonic acid Openeye Name: 5-acetamido-4-hydroxy-naphthalene-1,2-disulfonic acid CAS Name: 5-acetamido-4-hydroxynaphthalene-1,2-disulfonic acid IUPAC Name: 5-acetamido-4-hydroxynaphthalene-1,2-disulfonic acid Traditional Name: 5-acetamido-4-hydroxy-naphthalene-1,2-disulfonic acid Formula: C12H11NO8S2 MolecularWeight: 361.34764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC2=C1C(=CC(=C2S(=O)(=O)O)S(=O)(=O)O)O

Isomeric SMILES

CC(=O)NC1=CC=CC2=C1C(=CC(=C2S(=O)(=O)O)S(=O)(=O)O)O

InChI

InChI=1S/C12H11NO8S2/c1-6(14)13-8-4-2-3-7-11(8)9(15)5-10(22(16,17)18)12(7)23(19,20)21/h2-5,15H,1H3,(H,13,14)(H,16,17,18)(H,19,20,21)