methyl (2S)-1-(phenylsulfonyl)piperazine-2-carboxylate

Systemtic Name: methyl (2S)-1-(phenylsulfonyl)piperazine-2-carboxylate Openeye Name: methyl (2S)-1-(benzenesulfonyl)piperazine-2-carboxylate CAS Name: (2S)-1-(benzenesulfonyl)-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-(benzenesulfonyl)piperazine-2-carboxylate Traditional Name: (2S)-1-besylpiperazine-2-carboxylic acid methyl ester Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CNCCN1S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1CNCCN1S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H16N2O4S/c1-18-12(15)11-9-13-7-8-14(11)19(16,17)10-5-3-2-4-6-10/h2-6,11,13H,7-9H2,1H3/t11-/m0/s1