1-(phenylcarbonyl)-4-(phenylsulfonyl)piperazine-2-carboxylic acid

Systemtic Name: 1-(phenylcarbonyl)-4-(phenylsulfonyl)piperazine-2-carboxylic acid Openeye Name: 4-(benzenesulfonyl)-1-benzoyl-piperazine-2-carboxylic acid CAS Name: 4-(benzenesulfonyl)-1-benzoyl-2-piperazinecarboxylic acid IUPAC Name: 4-(benzenesulfonyl)-1-benzoylpiperazine-2-carboxylic acid Traditional Name: 1-benzoyl-4-besyl-piperazine-2-carboxylic acid Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1S(=O)(=O)C2=CC=CC=C2)C(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(C(CN1S(=O)(=O)C2=CC=CC=C2)C(=O)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O5S/c21-17(14-7-3-1-4-8-14)20-12-11-19(13-16(20)18(22)23)26(24,25)15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,22,23)