4-oxidanyl-3-sulfooxy-naphthalene-1,7-disulfonic acid

Systemtic Name: 4-oxidanyl-3-sulfooxy-naphthalene-1,7-disulfonic acid Openeye Name: 4-hydroxy-3-sulfooxy-naphthalene-1,7-disulfonic acid CAS Name: 4-hydroxy-3-sulfooxynaphthalene-1,7-disulfonic acid IUPAC Name: 4-hydroxy-3-sulfooxynaphthalene-1,7-disulfonic acid Traditional Name: 4-hydroxy-3-sulfoxy-naphthalene-1,7-disulfonic acid Formula: C10H8O11S3 MolecularWeight: 400.35892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CC(=C2C=C1S(=O)(=O)O)S(=O)(=O)O)OS(=O)(=O)O)O

Isomeric SMILES

C1=CC2=C(C(=CC(=C2C=C1S(=O)(=O)O)S(=O)(=O)O)OS(=O)(=O)O)O

InChI

InChI=1S/C10H8O11S3/c11-10-6-2-1-5(22(12,13)14)3-7(6)9(23(15,16)17)4-8(10)21-24(18,19)20/h1-4,11H,(H,12,13,14)(H,15,16,17)(H,18,19,20)