5-azanyl-2-(4-azanylphenoxy)benzenesulfonate; trimethylazanium

Systemtic Name: 5-azanyl-2-(4-azanylphenoxy)benzenesulfonate; trimethylazanium Openeye Name: 5-amino-2-(4-aminophenoxy)benzenesulfonate; trimethylammonium CAS Name: 5-amino-2-(4-aminophenoxy)benzenesulfonate; trimethylammonium IUPAC Name: 5-amino-2-(4-aminophenoxy)benzenesulfonate; trimethylazanium Traditional Name: 5-amino-2-(4-aminophenoxy)besylate; trimethylammonium Formula: C15H21N3O4S MolecularWeight: 339.40994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C.C1=CC(=CC=C1N)OC2=C(C=C(C=C2)N)S(=O)(=O)[O-]

Isomeric SMILES

C[NH+](C)C.C1=CC(=CC=C1N)OC2=C(C=C(C=C2)N)S(=O)(=O)[O-]

InChI

InChI=1S/C12H12N2O4S.C3H9N/c13-8-1-4-10(5-2-8)18-11-6-3-9(14)7-12(11)19(15,16)17;1-4(2)3/h1-7H,13-14H2,(H,15,16,17);1-3H3