dicyclopentyl-methyl-[2-[3-(methylsulfonylamino)-2-oxidanyl-phenyl]-2-oxidanyl-ethyl]azanium

Systemtic Name: dicyclopentyl-methyl-[2-[3-(methylsulfonylamino)-2-oxidanyl-phenyl]-2-oxidanyl-ethyl]azanium Openeye Name: dicyclopentyl-[2-hydroxy-2-[2-hydroxy-3-(methanesulfonamido)phenyl]ethyl]-methyl-ammonium CAS Name: dicyclopentyl-[2-hydroxy-2-[2-hydroxy-3-(methanesulfonamido)phenyl]ethyl]-methylammonium IUPAC Name: dicyclopentyl-[2-hydroxy-2-[2-hydroxy-3-(methanesulfonamido)phenyl]ethyl]-methylazanium Traditional Name: dicyclopentyl-[2-hydroxy-2-[2-hydroxy-3-(methanesulfonamido)phenyl]ethyl]-methyl-ammonium Formula: C20H33N2O4S+ MolecularWeight: 397.55202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](CC(C1=C(C(=CC=C1)NS(=O)(=O)C)O)O)(C2CCCC2)C3CCCC3

Isomeric SMILES

C[N+](CC(C1=C(C(=CC=C1)NS(=O)(=O)C)O)O)(C2CCCC2)C3CCCC3

InChI

InChI=1S/C20H32N2O4S/c1-22(15-8-3-4-9-15,16-10-5-6-11-16)14-19(23)17-12-7-13-18(20(17)24)21-27(2,25)26/h7,12-13,15-16,19,21,23H,3-6,8-11,14H2,1-2H3/p+1