2-[methyl-(2-methyl-5-methylsulfonyl-phenyl)carbonyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-(2-methyl-5-methylsulfonyl-phenyl)carbonyl-amino]ethanoic acid Openeye Name: 2-[methyl-(2-methyl-5-methylsulfonyl-benzoyl)amino]acetic acid CAS Name: 2-[methyl-[(2-methyl-5-methylsulfonylphenyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[methyl-(2-methyl-5-methylsulfonylbenzoyl)amino]acetic acid Traditional Name: 2-[(5-mesyl-2-methyl-benzoyl)-methyl-amino]acetic acid Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N(C)CC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N(C)CC(=O)O

InChI

InChI=1S/C12H15NO5S/c1-8-4-5-9(19(3,17)18)6-10(8)12(16)13(2)7-11(14)15/h4-6H,7H2,1-3H3,(H,14,15)