2-[(2-methyl-4-sulfo-phenoxy)methyl]benzoic acid

Systemtic Name: 2-[(2-methyl-4-sulfo-phenoxy)methyl]benzoic acid Openeye Name: 2-[(2-methyl-4-sulfo-phenoxy)methyl]benzoic acid CAS Name: 2-[(2-methyl-4-sulfophenoxy)methyl]benzoic acid IUPAC Name: 2-[(2-methyl-4-sulfophenoxy)methyl]benzoic acid Traditional Name: 2-[(2-methyl-4-sulfo-phenoxy)methyl]benzoic acid Formula: C15H14O6S MolecularWeight: 322.33306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)O)OCC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)O)OCC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H14O6S/c1-10-8-12(22(18,19)20)6-7-14(10)21-9-11-4-2-3-5-13(11)15(16)17/h2-8H,9H2,1H3,(H,16,17)(H,18,19,20)