1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-ethyl-piperazine; ethanedioic acid

Systemtic Name: 1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-ethyl-piperazine; ethanedioic acid Openeye Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidyl]-4-ethyl-piperazine; oxalic acid CAS Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-4-ethylpiperazine; oxalic acid IUPAC Name: 1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-ethylpiperazine; oxalic acid Traditional Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidyl]-4-ethyl-piperazine; oxalic acid Formula: C19H28ClN3O6S MolecularWeight: 461.96012

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26ClN3O2S.C2H2O4/c1-2-19-11-13-20(14-12-19)16-7-9-21(10-8-16)24(22,23)17-5-3-15(18)4-6-17;3-1(4)2(5)6/h3-6,16H,2,7-14H2,1H3;(H,3,4)(H,5,6)