(3R)-3-(4-methoxy-3-methyl-phenyl)sulfonylbutanoate

Systemtic Name: (3R)-3-(4-methoxy-3-methyl-phenyl)sulfonylbutanoate Openeye Name: (3R)-3-(4-methoxy-3-methyl-phenyl)sulfonylbutanoate CAS Name: (3R)-3-(4-methoxy-3-methylphenyl)sulfonylbutanoate IUPAC Name: (3R)-3-(4-methoxy-3-methylphenyl)sulfonylbutanoate Traditional Name: (3R)-3-(4-methoxy-3-methyl-phenyl)sulfonylbutyrate Formula: C12H15O5S- MolecularWeight: 271.3095

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C(C)CC(=O)[O-])OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H](C)CC(=O)[O-])OC

InChI

InChI=1S/C12H16O5S/c1-8-6-10(4-5-11(8)17-3)18(15,16)9(2)7-12(13)14/h4-6,9H,7H2,1-3H3,(H,13,14)/p-1/t9-/m1/s1