4-(4-methylphenyl)sulfonylpiperazine-1-carboxylic acid

Systemtic Name: 4-(4-methylphenyl)sulfonylpiperazine-1-carboxylic acid Openeye Name: 4-(p-tolylsulfonyl)piperazine-1-carboxylic acid CAS Name: 4-(4-methylphenyl)sulfonyl-1-piperazinecarboxylic acid IUPAC Name: 4-(4-methylphenyl)sulfonylpiperazine-1-carboxylic acid Traditional Name: 4-tosylpiperazine-1-carboxylic acid Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)O

InChI

InChI=1S/C12H16N2O4S/c1-10-2-4-11(5-3-10)19(17,18)14-8-6-13(7-9-14)12(15)16/h2-5H,6-9H2,1H3,(H,15,16)