2-[[5-[(3-chlorophenyl)methylsulfonylmethyl]furan-2-yl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[5-[(3-chlorophenyl)methylsulfonylmethyl]furan-2-yl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[5-[(3-chlorophenyl)methylsulfonylmethyl]furan-2-carbonyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[5-[(3-chlorophenyl)methylsulfonylmethyl]-2-furanyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[5-[(3-chlorophenyl)methylsulfonylmethyl]furan-2-carbonyl]amino]ethyl-diethylazanium Traditional Name: 2-[[5-[(3-chlorobenzyl)sulfonylmethyl]-2-furoyl]amino]ethyl-diethyl-ammonium Formula: C19H26ClN2O4S+ MolecularWeight: 413.93874

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC=C(O1)CS(=O)(=O)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC=C(O1)CS(=O)(=O)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H25ClN2O4S/c1-3-22(4-2)11-10-21-19(23)18-9-8-17(26-18)14-27(24,25)13-15-6-5-7-16(20)12-15/h5-9,12H,3-4,10-11,13-14H2,1-2H3,(H,21,23)/p+1