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

Systemtic Name: 1-ethylsulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium Openeye Name: 1-ethylsulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium CAS Name: 1-ethylsulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium IUPAC Name: 1-ethylsulfonyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium Traditional Name: 1-esyl-4-[(1S,2S)-2-methylcyclohexyl]piperazin-4-ium Formula: C13H27N2O2S+ MolecularWeight: 275.43068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC[NH+](CC1)C2CCCCC2C

Isomeric SMILES

CCS(=O)(=O)N1CC[NH+](CC1)[C@H]2CCCC[C@@H]2C

InChI

InChI=1S/C13H26N2O2S/c1-3-18(16,17)15-10-8-14(9-11-15)13-7-5-4-6-12(13)2/h12-13H,3-11H2,1-2H3/p+1/t12-,13-/m0/s1