dimethyl-[2-[3-methylbutanoyl-[(4-propan-2-ylsulfonyloxyphenyl)methyl]amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[3-methylbutanoyl-[(4-propan-2-ylsulfonyloxyphenyl)methyl]amino]ethyl]azanium Openeye Name: 2-[(4-isopropylsulfonyloxyphenyl)methyl-(3-methylbutanoyl)amino]ethyl-dimethyl-ammonium CAS Name: dimethyl-[2-[(3-methyl-1-oxobutyl)-[(4-propan-2-ylsulfonyloxyphenyl)methyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[3-methylbutanoyl-[(4-propan-2-ylsulfonyloxyphenyl)methyl]amino]ethyl]azanium Traditional Name: 2-[(4-isopropylsulfonyloxybenzyl)-isovaleryl-amino]ethyl-dimethyl-ammonium Formula: C19H33N2O4S+ MolecularWeight: 385.54132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(CC[NH+](C)C)CC1=CC=C(C=C1)OS(=O)(=O)C(C)C

Isomeric SMILES

CC(C)CC(=O)N(CC[NH+](C)C)CC1=CC=C(C=C1)OS(=O)(=O)C(C)C

InChI

InChI=1S/C19H32N2O4S/c1-15(2)13-19(22)21(12-11-20(5)6)14-17-7-9-18(10-8-17)25-26(23,24)16(3)4/h7-10,15-16H,11-14H2,1-6H3/p+1