4-methyl-3-(4-methylphenoxy)sulfonyl-benzoic acid

Systemtic Name: 4-methyl-3-(4-methylphenoxy)sulfonyl-benzoic acid Openeye Name: 4-methyl-3-(4-methylphenoxy)sulfonyl-benzoic acid CAS Name: 4-methyl-3-(4-methylphenoxy)sulfonylbenzoic acid IUPAC Name: 4-methyl-3-(4-methylphenoxy)sulfonylbenzoic acid Traditional Name: 4-methyl-3-(4-methylphenoxy)sulfonyl-benzoic acid Formula: C15H14O5S MolecularWeight: 306.33366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C15H14O5S/c1-10-3-7-13(8-4-10)20-21(18,19)14-9-12(15(16)17)6-5-11(14)2/h3-9H,1-2H3,(H,16,17)