2-(4-methyl-2-sulfo-phenoxy)ethanoic acid

Systemtic Name: 2-(4-methyl-2-sulfo-phenoxy)ethanoic acid Openeye Name: 2-(4-methyl-2-sulfo-phenoxy)acetic acid CAS Name: 2-(4-methyl-2-sulfophenoxy)acetic acid IUPAC Name: 2-(4-methyl-2-sulfophenoxy)acetic acid Traditional Name: 2-(4-methyl-2-sulfo-phenoxy)acetic acid Formula: C9H10O6S MolecularWeight: 246.2371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)O)S(=O)(=O)O

InChI

InChI=1S/C9H10O6S/c1-6-2-3-7(15-5-9(10)11)8(4-6)16(12,13)14/h2-4H,5H2,1H3,(H,10,11)(H,12,13,14)