4-oxidanyl-5-phenylazanyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 4-oxidanyl-5-phenylazanyl-naphthalene-2,7-disulfonic acid Openeye Name: 4-anilino-5-hydroxy-naphthalene-2,7-disulfonic acid CAS Name: 4-anilino-5-hydroxynaphthalene-2,7-disulfonic acid IUPAC Name: 4-anilino-5-hydroxynaphthalene-2,7-disulfonic acid Traditional Name: 4-anilino-5-hydroxy-naphthalene-2,7-disulfonic acid Formula: C16H13NO7S2 MolecularWeight: 395.40692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

InChI

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