3-methyl-4-phenoxy-benzenesulfonic acid

Systemtic Name: 3-methyl-4-phenoxy-benzenesulfonic acid Openeye Name: 3-methyl-4-phenoxy-benzenesulfonic acid CAS Name: 3-methyl-4-phenoxybenzenesulfonic acid IUPAC Name: 3-methyl-4-phenoxybenzenesulfonic acid Traditional Name: 3-methyl-4-phenoxy-besylic acid Formula: C13H12O4S MolecularWeight: 264.29698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12O4S/c1-10-9-12(18(14,15)16)7-8-13(10)17-11-5-3-2-4-6-11/h2-9H,1H3,(H,14,15,16)