1-cycloheptyl-4-(phenylsulfonyl)piperazine; ethanedioic acid

Systemtic Name: 1-cycloheptyl-4-(phenylsulfonyl)piperazine; ethanedioic acid Openeye Name: 1-(benzenesulfonyl)-4-cycloheptyl-piperazine; oxalic acid CAS Name: 1-(benzenesulfonyl)-4-cycloheptylpiperazine; oxalic acid IUPAC Name: 1-(benzenesulfonyl)-4-cycloheptylpiperazine; oxalic acid Traditional Name: 1-besyl-4-cycloheptyl-piperazine; oxalic acid Formula: C19H28N2O6S MolecularWeight: 412.50042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCC(CC1)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26N2O2S.C2H2O4/c20-22(21,17-10-6-3-7-11-17)19-14-12-18(13-15-19)16-8-4-1-2-5-9-16;3-1(4)2(5)6/h3,6-7,10-11,16H,1-2,4-5,8-9,12-15H2;(H,3,4)(H,5,6)