2-(dimethylamino)-2-(4-methylsulfonylphenyl)propanoic acid

Systemtic Name: 2-(dimethylamino)-2-(4-methylsulfonylphenyl)propanoic acid Openeye Name: 2-(dimethylamino)-2-(4-methylsulfonylphenyl)propanoic acid CAS Name: 2-(dimethylamino)-2-(4-methylsulfonylphenyl)propanoic acid IUPAC Name: 2-(dimethylamino)-2-(4-methylsulfonylphenyl)propanoic acid Traditional Name: 2-(dimethylamino)-2-(4-mesylphenyl)propionic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)(C(=O)O)N(C)C

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)(C(=O)O)N(C)C

InChI

InChI=1S/C12H17NO4S/c1-12(11(14)15,13(2)3)9-5-7-10(8-6-9)18(4,16)17/h5-8H,1-4H3,(H,14,15)