2-azanyl-2-(4-methylphenyl)sulfonyl-pentanedioic acid

Systemtic Name: 2-azanyl-2-(4-methylphenyl)sulfonyl-pentanedioic acid Openeye Name: 2-amino-2-(p-tolylsulfonyl)pentanedioic acid CAS Name: 2-amino-2-(4-methylphenyl)sulfonylpentanedioic acid IUPAC Name: 2-amino-2-(4-methylphenyl)sulfonylpentanedioic acid Traditional Name: 2-amino-2-tosyl-glutaric acid Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO6S/c1-8-2-4-9(5-3-8)20(18,19)12(13,11(16)17)7-6-10(14)15/h2-5H,6-7,13H2,1H3,(H,14,15)(H,16,17)