2-[ethanoyl-[(4-propan-2-ylsulfonyloxyphenyl)methyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[ethanoyl-[(4-propan-2-ylsulfonyloxyphenyl)methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[acetyl-[(4-isopropylsulfonyloxyphenyl)methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[acetyl-[(4-propan-2-ylsulfonyloxyphenyl)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[acetyl-[(4-propan-2-ylsulfonyloxyphenyl)methyl]amino]ethyl-dimethylazanium Traditional Name: 2-[acetyl-(4-isopropylsulfonyloxybenzyl)amino]ethyl-dimethyl-ammonium Formula: C16H27N2O4S+ MolecularWeight: 343.46158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)OC1=CC=C(C=C1)CN(CC[NH+](C)C)C(=O)C

Isomeric SMILES

CC(C)S(=O)(=O)OC1=CC=C(C=C1)CN(CC[NH+](C)C)C(=O)C

InChI

InChI=1S/C16H26N2O4S/c1-13(2)23(20,21)22-16-8-6-15(7-9-16)12-18(14(3)19)11-10-17(4)5/h6-9,13H,10-12H2,1-5H3/p+1