1-(3-chloranylpropylsulfonyl)-4-methylsulfonyl-piperazine-2-carboxylic acid

Systemtic Name: 1-(3-chloranylpropylsulfonyl)-4-methylsulfonyl-piperazine-2-carboxylic acid Openeye Name: 1-(3-chloropropylsulfonyl)-4-methylsulfonyl-piperazine-2-carboxylic acid CAS Name: 1-(3-chloropropylsulfonyl)-4-methylsulfonyl-2-piperazinecarboxylic acid IUPAC Name: 1-(3-chloropropylsulfonyl)-4-methylsulfonylpiperazine-2-carboxylic acid Traditional Name: 1-(3-chloropropylsulfonyl)-4-mesyl-piperazine-2-carboxylic acid Formula: C9H17ClN2O6S2 MolecularWeight: 348.82408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(C(C1)C(=O)O)S(=O)(=O)CCCCl

Isomeric SMILES

CS(=O)(=O)N1CCN(C(C1)C(=O)O)S(=O)(=O)CCCCl

InChI

InChI=1S/C9H17ClN2O6S2/c1-19(15,16)11-4-5-12(8(7-11)9(13)14)20(17,18)6-2-3-10/h8H,2-7H2,1H3,(H,13,14)