3-methyl-4-(4-sulfophenoxy)benzenesulfonic acid

Systemtic Name: 3-methyl-4-(4-sulfophenoxy)benzenesulfonic acid Openeye Name: 3-methyl-4-(4-sulfophenoxy)benzenesulfonic acid CAS Name: 3-methyl-4-(4-sulfophenoxy)benzenesulfonic acid IUPAC Name: 3-methyl-4-(4-sulfophenoxy)benzenesulfonic acid Traditional Name: 3-methyl-4-(4-sulfophenoxy)besylic acid Formula: C13H12O7S2 MolecularWeight: 344.36018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)O)OC2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)O)OC2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C13H12O7S2/c1-9-8-12(22(17,18)19)6-7-13(9)20-10-2-4-11(5-3-10)21(14,15)16/h2-8H,1H3,(H,14,15,16)(H,17,18,19)