1-(4-chlorophenyl)sulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium CAS Name: 1-(4-chlorophenyl)sulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium Formula: C17H26ClN2O2S+ MolecularWeight: 357.91854

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@H]1CCCC[C@@H]1[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H25ClN2O2S/c1-14-4-2-3-5-17(14)19-10-12-20(13-11-19)23(21,22)16-8-6-15(18)7-9-16/h6-9,14,17H,2-5,10-13H2,1H3/p+1/t14-,17-/m0/s1