1-(4-chlorophenyl)sulfonyl-4-[(4-ethylphenyl)methyl]piperazine; ethanedioic acid

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-[(4-ethylphenyl)methyl]piperazine; ethanedioic acid Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-[(4-ethylphenyl)methyl]piperazine; oxalic acid CAS Name: 1-(4-chlorophenyl)sulfonyl-4-[(4-ethylphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-[(4-ethylphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-(4-ethylbenzyl)piperazine; oxalic acid Formula: C21H25ClN2O6S MolecularWeight: 468.951

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23ClN2O2S.C2H2O4/c1-2-16-3-5-17(6-4-16)15-21-11-13-22(14-12-21)25(23,24)19-9-7-18(20)8-10-19;3-1(4)2(5)6/h3-10H,2,11-15H2,1H3;(H,3,4)(H,5,6)