(2R)-2-[(3-methylphenyl)methylsulfonyl]propanoic acid

Systemtic Name: (2R)-2-[(3-methylphenyl)methylsulfonyl]propanoic acid Openeye Name: (2R)-2-(m-tolylmethylsulfonyl)propanoic acid CAS Name: (2R)-2-[(3-methylphenyl)methylsulfonyl]propanoic acid IUPAC Name: (2R)-2-[(3-methylphenyl)methylsulfonyl]propanoic acid Traditional Name: (2R)-2-(3-methylbenzyl)sulfonylpropionic acid Formula: C11H14O4S MolecularWeight: 242.29146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)C(C)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)[C@H](C)C(=O)O

InChI

InChI=1S/C11H14O4S/c1-8-4-3-5-10(6-8)7-16(14,15)9(2)11(12)13/h3-6,9H,7H2,1-2H3,(H,12,13)/t9-/m1/s1