2-acetamido-2-(2,4-dimethylphenyl)ethanesulfonic acid

Systemtic Name: 2-acetamido-2-(2,4-dimethylphenyl)ethanesulfonic acid Openeye Name: 2-acetamido-2-(2,4-dimethylphenyl)ethanesulfonic acid CAS Name: 2-acetamido-2-(2,4-dimethylphenyl)ethanesulfonic acid IUPAC Name: 2-acetamido-2-(2,4-dimethylphenyl)ethanesulfonic acid Traditional Name: 2-acetamido-2-(2,4-dimethylphenyl)ethanesulfonic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4S/c1-8-4-5-11(9(2)6-8)12(13-10(3)14)7-18(15,16)17/h4-6,12H,7H2,1-3H3,(H,13,14)(H,15,16,17)