[3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium

Systemtic Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium Openeye Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-[(2S)-2-hydroxy-2-phenyl-ethyl]-methyl-ammonium CAS Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-4-imidazolyl]methyl-[(2S)-2-hydroxy-2-phenylethyl]-methylammonium IUPAC Name: [3-(cyclohexylmethyl)-2-methylsulfonylimidazol-4-yl]methyl-[(2S)-2-hydroxy-2-phenylethyl]-methylazanium Traditional Name: [3-(cyclohexylmethyl)-2-mesyl-imidazol-4-yl]methyl-[(2S)-2-hydroxy-2-phenyl-ethyl]-methyl-ammonium Formula: C21H32N3O3S+ MolecularWeight: 406.56208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN=C(N1CC2CCCCC2)S(=O)(=O)C)CC(C3=CC=CC=C3)O

Isomeric SMILES

C[NH+](CC1=CN=C(N1CC2CCCCC2)S(=O)(=O)C)C[C@H](C3=CC=CC=C3)O

InChI

InChI=1S/C21H31N3O3S/c1-23(16-20(25)18-11-7-4-8-12-18)15-19-13-22-21(28(2,26)27)24(19)14-17-9-5-3-6-10-17/h4,7-8,11-13,17,20,25H,3,5-6,9-10,14-16H2,1-2H3/p+1/t20-/m1/s1