1-butan-2-yl-4-(phenylsulfonyl)piperazine; ethanedioic acid

Systemtic Name: 1-butan-2-yl-4-(phenylsulfonyl)piperazine; ethanedioic acid Openeye Name: 1-(benzenesulfonyl)-4-sec-butyl-piperazine; oxalic acid CAS Name: 1-(benzenesulfonyl)-4-butan-2-ylpiperazine; oxalic acid IUPAC Name: 1-(benzenesulfonyl)-4-butan-2-ylpiperazine; oxalic acid Traditional Name: 1-besyl-4-sec-butyl-piperazine; oxalic acid Formula: C16H24N2O6S MolecularWeight: 372.43656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H22N2O2S.C2H2O4/c1-3-13(2)15-9-11-16(12-10-15)19(17,18)14-7-5-4-6-8-14;3-1(4)2(5)6/h4-8,13H,3,9-12H2,1-2H3;(H,3,4)(H,5,6)