(2R,6S)-1-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-2,6-dimethyl-piperidin-1-ium

Systemtic Name: (2R,6S)-1-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-2,6-dimethyl-piperidin-1-ium Openeye Name: (2R,6S)-1-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-2,6-dimethyl-piperidin-1-ium CAS Name: (2R,6S)-1-[[2-ethylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl]-2,6-dimethylpiperidin-1-ium IUPAC Name: (2R,6S)-1-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-2,6-dimethylpiperidin-1-ium Traditional Name: (2R,6S)-1-[[2-esyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-2,6-dimethyl-piperidin-1-ium Formula: C22H34N3O2S+ MolecularWeight: 404.58926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)C[NH+]3C(CCCC3C)C

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)C[NH+]3[C@@H](CCC[C@@H]3C)C

InChI

InChI=1S/C22H33N3O2S/c1-4-28(26,27)22-23-16-21(17-25-18(2)10-8-11-19(25)3)24(22)15-9-14-20-12-6-5-7-13-20/h5-7,12-13,16,18-19H,4,8-11,14-15,17H2,1-3H3/p+1/t18-,19+