2-[3-[[(E)-diazanylidenemethyl]diazenyl]-2-(2-sulfophenyl)phenyl]benzoic acid

Systemtic Name: 2-[3-[[(E)-diazanylidenemethyl]diazenyl]-2-(2-sulfophenyl)phenyl]benzoic acid Openeye Name: 2-[3-[(E)-hydrazinylidenemethyl]azo-2-(2-sulfophenyl)phenyl]benzoic acid CAS Name: 2-[3-[(E)-hydrazinylidenemethyl]azo-2-(2-sulfophenyl)phenyl]benzoic acid IUPAC Name: 2-[3-[[(E)-hydrazinylidenemethyl]diazenyl]-2-(2-sulfophenyl)phenyl]benzoic acid Traditional Name: 2-[3-[(E)-hydrazonomethyl]azo-2-(2-sulfophenyl)phenyl]benzoic acid Formula: C20H16N4O5S MolecularWeight: 424.42984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C(=CC=C2)N=NC=NN)C3=CC=CC=C3S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C(=CC=C2)N=N/C=N/N)C3=CC=CC=C3S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C20H16N4O5S/c21-22-12-23-24-17-10-5-9-14(13-6-1-2-7-15(13)20(25)26)19(17)16-8-3-4-11-18(16)30(27,28)29/h1-12H,21H2,(H,25,26)(H,27,28,29)/b22-12+,24-23?