4-[methyl-(2-methylphenyl)sulfonyl-amino]butanoic acid

Systemtic Name: 4-[methyl-(2-methylphenyl)sulfonyl-amino]butanoic acid Openeye Name: 4-[methyl(o-tolylsulfonyl)amino]butanoic acid CAS Name: 4-[methyl-(2-methylphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[methyl-(2-methylphenyl)sulfonylamino]butanoic acid Traditional Name: 4-[methyl(o-tolylsulfonyl)amino]butyric acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)N(C)CCCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C12H17NO4S/c1-10-6-3-4-7-11(10)18(16,17)13(2)9-5-8-12(14)15/h3-4,6-7H,5,8-9H2,1-2H3,(H,14,15)