diethyl-[3-[4-(methylsulfonylamino)phenyl]propyl]-(4-oxidanylheptyl)azanium

Systemtic Name: diethyl-[3-[4-(methylsulfonylamino)phenyl]propyl]-(4-oxidanylheptyl)azanium Openeye Name: diethyl-(4-hydroxyheptyl)-[3-[4-(methanesulfonamido)phenyl]propyl]ammonium CAS Name: diethyl-(4-hydroxyheptyl)-[3-[4-(methanesulfonamido)phenyl]propyl]ammonium IUPAC Name: diethyl-(4-hydroxyheptyl)-[3-[4-(methanesulfonamido)phenyl]propyl]azanium Traditional Name: diethyl-(4-hydroxyheptyl)-[3-[4-(methanesulfonamido)phenyl]propyl]ammonium Formula: C21H39N2O3S+ MolecularWeight: 399.61096

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC[N+](CC)(CC)CCCC1=CC=C(C=C1)NS(=O)(=O)C)O

Isomeric SMILES

CCCC(CCC[N+](CC)(CC)CCCC1=CC=C(C=C1)NS(=O)(=O)C)O

InChI

InChI=1S/C21H39N2O3S/c1-5-10-21(24)12-9-18-23(6-2,7-3)17-8-11-19-13-15-20(16-14-19)22-27(4,25)26/h13-16,21-22,24H,5-12,17-18H2,1-4H3/q+1