butan-2-yl-diethyl-(2-methylprop-2-enoyloxy)azanium; methyl sulfate

Systemtic Name: butan-2-yl-diethyl-(2-methylprop-2-enoyloxy)azanium; methyl sulfate Openeye Name: diethyl-(2-methylprop-2-enoyloxy)-sec-butyl-ammonium; methyl sulfate CAS Name: butan-2-yl-diethyl-(2-methyl-1-oxoprop-2-enoxy)ammonium; methyl sulfate IUPAC Name: butan-2-yl-diethyl-(2-methylprop-2-enoyloxy)azanium; methyl sulfate Traditional Name: diethyl-methacryloyloxy-sec-butyl-ammonium; methyl sulfate Formula: C13H27NO6S MolecularWeight: 325.42158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[N+](CC)(CC)OC(=O)C(=C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCC(C)[N+](CC)(CC)OC(=O)C(=C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C12H24NO2.CH4O4S/c1-7-11(6)13(8-2,9-3)15-12(14)10(4)5;1-5-6(2,3)4/h11H,4,7-9H2,1-3,5-6H3;1H3,(H,2,3,4)/q+1;/p-1