5-oxidanyl-2-[(3-sulfophenyl)amino]naphthalene-1-sulfonic acid

Systemtic Name: 5-oxidanyl-2-[(3-sulfophenyl)amino]naphthalene-1-sulfonic acid Openeye Name: 5-hydroxy-2-(3-sulfoanilino)naphthalene-1-sulfonic acid CAS Name: 5-hydroxy-2-(3-sulfoanilino)-1-naphthalenesulfonic acid IUPAC Name: 5-hydroxy-2-(3-sulfoanilino)naphthalene-1-sulfonic acid Traditional Name: 5-hydroxy-2-(3-sulfoanilino)naphthalene-1-sulfonic acid Formula: C16H13NO7S2 MolecularWeight: 395.40692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)NC2=C(C3=C(C=C2)C(=CC=C3)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)NC2=C(C3=C(C=C2)C(=CC=C3)O)S(=O)(=O)O

InChI

InChI=1S/C16H13NO7S2/c18-15-6-2-5-13-12(15)7-8-14(16(13)26(22,23)24)17-10-3-1-4-11(9-10)25(19,20)21/h1-9,17-18H,(H,19,20,21)(H,22,23,24)