2-[(5-chloranyl-2-ethylsulfonyloxy-phenyl)methyl-(furan-2-ylcarbonyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5-chloranyl-2-ethylsulfonyloxy-phenyl)methyl-(furan-2-ylcarbonyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(5-chloro-2-ethylsulfonyloxy-phenyl)methyl-(furan-2-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(5-chloro-2-ethylsulfonyloxyphenyl)methyl-[2-furanyl(oxo)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5-chloro-2-ethylsulfonyloxyphenyl)methyl-(furan-2-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(5-chloro-2-esyloxy-benzyl)-(2-furoyl)amino]ethyl-dimethyl-ammonium Formula: C18H24ClN2O5S+ MolecularWeight: 415.91156

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=C(C=C1)Cl)CN(CC[NH+](C)C)C(=O)C2=CC=CO2

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=C(C=C1)Cl)CN(CC[NH+](C)C)C(=O)C2=CC=CO2

InChI

InChI=1S/C18H23ClN2O5S/c1-4-27(23,24)26-16-8-7-15(19)12-14(16)13-21(10-9-20(2)3)18(22)17-6-5-11-25-17/h5-8,11-12H,4,9-10,13H2,1-3H3/p+1