2-(2,4,6-trimethylphenyl)sulfonylbenzoic acid

Systemtic Name: 2-(2,4,6-trimethylphenyl)sulfonylbenzoic acid Openeye Name: 2-(2,4,6-trimethylphenyl)sulfonylbenzoic acid CAS Name: 2-(2,4,6-trimethylphenyl)sulfonylbenzoic acid IUPAC Name: 2-(2,4,6-trimethylphenyl)sulfonylbenzoic acid Traditional Name: 2-mesitylsulfonylbenzoic acid Formula: C16H16O4S MolecularWeight: 304.36084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)C2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)C2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C16H16O4S/c1-10-8-11(2)15(12(3)9-10)21(19,20)14-7-5-4-6-13(14)16(17)18/h4-9H,1-3H3,(H,17,18)