1-(4-chlorophenyl)sulfonyl-4-cycloheptyl-piperazine; ethanedioic acid

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-cycloheptyl-piperazine; ethanedioic acid Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-cycloheptyl-piperazine; oxalic acid CAS Name: 1-(4-chlorophenyl)sulfonyl-4-cycloheptylpiperazine; oxalic acid IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-cycloheptylpiperazine; oxalic acid Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-cycloheptyl-piperazine; oxalic acid Formula: C19H27ClN2O6S MolecularWeight: 446.94548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25ClN2O2S.C2H2O4/c18-15-7-9-17(10-8-15)23(21,22)20-13-11-19(12-14-20)16-5-3-1-2-4-6-16;3-1(4)2(5)6/h7-10,16H,1-6,11-14H2;(H,3,4)(H,5,6)