5-azanyl-4-oxidanyl-7-(phenylsulfonyloxysulfonyl)naphthalene-2-sulfonic acid

Systemtic Name: 5-azanyl-4-oxidanyl-7-(phenylsulfonyloxysulfonyl)naphthalene-2-sulfonic acid Openeye Name: 5-amino-7-(benzenesulfonyloxysulfonyl)-4-hydroxy-naphthalene-2-sulfonic acid CAS Name: 5-amino-7-(benzenesulfonyloxysulfonyl)-4-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 5-amino-7-(benzenesulfonyloxysulfonyl)-4-hydroxynaphthalene-2-sulfonic acid Traditional Name: 5-amino-7-besyloxysulfonyl-4-hydroxy-naphthalene-2-sulfonic acid Formula: C16H13NO9S3 MolecularWeight: 459.47072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OS(=O)(=O)C2=CC(=C3C(=C2)C=C(C=C3O)S(=O)(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OS(=O)(=O)C2=CC(=C3C(=C2)C=C(C=C3O)S(=O)(=O)O)N

InChI

InChI=1S/C16H13NO9S3/c17-14-8-13(7-10-6-12(27(19,20)21)9-15(18)16(10)14)29(24,25)26-28(22,23)11-4-2-1-3-5-11/h1-9,18H,17H2,(H,19,20,21)