1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-(4-methylphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-(4-methylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-(p-tolylsulfonyl)piperazin-1-ium CAS Name: 1-[[(1R)-1-cyclohex-3-enyl]methyl]-4-(4-methylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-(4-methylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-tosyl-piperazin-1-ium Formula: C18H27N2O2S+ MolecularWeight: 335.48418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3CCC=CC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C[C@@H]3CCC=CC3

InChI

InChI=1S/C18H26N2O2S/c1-16-7-9-18(10-8-16)23(21,22)20-13-11-19(12-14-20)15-17-5-3-2-4-6-17/h2-3,7-10,17H,4-6,11-15H2,1H3/p+1/t17-/m0/s1