1-(cyclohexylmethyl)-2-methylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole

Systemtic Name: 1-(cyclohexylmethyl)-2-methylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole Openeye Name: 1-(cyclohexylmethyl)-2-methylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole CAS Name: 1-(cyclohexylmethyl)-2-methylsulfonyl-5-(1-pyrrolidin-1-iumylmethyl)imidazole IUPAC Name: 1-(cyclohexylmethyl)-2-methylsulfonyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole Traditional Name: 1-(cyclohexylmethyl)-2-mesyl-5-(pyrrolidin-1-ium-1-ylmethyl)imidazole Formula: C16H28N3O2S+ MolecularWeight: 326.47742

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(N1CC2CCCCC2)C[NH+]3CCCC3

Isomeric SMILES

CS(=O)(=O)C1=NC=C(N1CC2CCCCC2)C[NH+]3CCCC3

InChI

InChI=1S/C16H27N3O2S/c1-22(20,21)16-17-11-15(13-18-9-5-6-10-18)19(16)12-14-7-3-2-4-8-14/h11,14H,2-10,12-13H2,1H3/p+1