2-methyl-6-phenyl-benzenesulfonic acid

Systemtic Name: 2-methyl-6-phenyl-benzenesulfonic acid Openeye Name: 2-methyl-6-phenyl-benzenesulfonic acid CAS Name: 2-methyl-6-phenylbenzenesulfonic acid IUPAC Name: 2-methyl-6-phenylbenzenesulfonic acid Traditional Name: 2-methyl-6-phenyl-besylic acid Formula: C13H12O3S MolecularWeight: 248.29758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1S(=O)(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC(=C1S(=O)(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C13H12O3S/c1-10-6-5-9-12(13(10)17(14,15)16)11-7-3-2-4-8-11/h2-9H,1H3,(H,14,15,16)