8-azanyl-5-[[4-(4-sulfophenyl)phenyl]diazenyl]naphthalene-2-sulfonic acid

Systemtic Name: 8-azanyl-5-[[4-(4-sulfophenyl)phenyl]diazenyl]naphthalene-2-sulfonic acid Openeye Name: 8-amino-5-[4-(4-sulfophenyl)phenyl]azo-naphthalene-2-sulfonic acid CAS Name: 8-amino-5-[4-(4-sulfophenyl)phenyl]azo-2-naphthalenesulfonic acid IUPAC Name: 8-amino-5-[[4-(4-sulfophenyl)phenyl]diazenyl]naphthalene-2-sulfonic acid Traditional Name: 8-amino-5-[4-(4-sulfophenyl)phenyl]azo-naphthalene-2-sulfonic acid Formula: C22H17N3O6S2 MolecularWeight: 483.51688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)O)N=NC3=C4C=CC(=CC4=C(C=C3)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)O)N=NC3=C4C=CC(=CC4=C(C=C3)N)S(=O)(=O)O

InChI

InChI=1S/C22H17N3O6S2/c23-21-11-12-22(19-10-9-18(13-20(19)21)33(29,30)31)25-24-16-5-1-14(2-6-16)15-3-7-17(8-4-15)32(26,27)28/h1-13H,23H2,(H,26,27,28)(H,29,30,31)