4-oxidanyl-6-[(4-sulfophenyl)amino]naphthalene-2-sulfonic acid

Systemtic Name: 4-oxidanyl-6-[(4-sulfophenyl)amino]naphthalene-2-sulfonic acid Openeye Name: 4-hydroxy-6-(4-sulfoanilino)naphthalene-2-sulfonic acid CAS Name: 4-hydroxy-6-(4-sulfoanilino)-2-naphthalenesulfonic acid IUPAC Name: 4-hydroxy-6-(4-sulfoanilino)naphthalene-2-sulfonic acid Traditional Name: 4-hydroxy-6-(4-sulfoanilino)naphthalene-2-sulfonic acid Formula: C16H13NO7S2 MolecularWeight: 395.40692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)O)S(=O)(=O)O

InChI

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