2-(4-aminophenyl)sulfonyl-1-(2-sulfoperoxyethoxysulfonylperoxy)ethanesulfonic acid

Systemtic Name: 2-(4-aminophenyl)sulfonyl-1-(2-sulfoperoxyethoxysulfonylperoxy)ethanesulfonic acid Openeye Name: 2-(4-aminophenyl)sulfonyl-1-(2-sulfoperoxyethoxysulfonylperoxy)ethanesulfonic acid CAS Name: 2-(4-aminophenyl)sulfonyl-1-(2-sulfodioxyethoxysulfonyldioxy)ethanesulfonic acid IUPAC Name: 2-(4-aminophenyl)sulfonyl-1-(2-sulfoperoxyethoxysulfonylperoxy)ethanesulfonic acid Traditional Name: 2-sulfanilyl-1-(2-sulfoperoxyethoxysulfonylperoxy)ethanesulfonic acid Formula: C10H15NO15S4 MolecularWeight: 517.4838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)S(=O)(=O)CC(OOS(=O)(=O)OCCOOS(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N)S(=O)(=O)CC(OOS(=O)(=O)OCCOOS(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C10H15NO15S4/c11-8-1-3-9(4-2-8)27(12,13)7-10(28(14,15)16)24-26-30(20,21)23-6-5-22-25-29(17,18)19/h1-4,10H,5-7,11H2,(H,14,15,16)(H,17,18,19)