dibutyl-[1-(prop-2-enoylamino)ethyl]azanium; methyl sulfate

Systemtic Name: dibutyl-[1-(prop-2-enoylamino)ethyl]azanium; methyl sulfate Openeye Name: dibutyl-[1-(prop-2-enoylamino)ethyl]ammonium; methyl sulfate CAS Name: dibutyl-[1-(1-oxoprop-2-enylamino)ethyl]ammonium; methyl sulfate IUPAC Name: dibutyl-[1-(prop-2-enoylamino)ethyl]azanium; methyl sulfate Traditional Name: 1-acrylamidoethyl(dibutyl)ammonium; methyl sulfate Formula: C14H30N2O5S MolecularWeight: 338.4634

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)C(C)NC(=O)C=C.COS(=O)(=O)[O-]

Isomeric SMILES

CCCC[NH+](CCCC)C(C)NC(=O)C=C.COS(=O)(=O)[O-]

InChI

InChI=1S/C13H26N2O.CH4O4S/c1-5-8-10-15(11-9-6-2)12(4)14-13(16)7-3;1-5-6(2,3)4/h7,12H,3,5-6,8-11H2,1-2,4H3,(H,14,16);1H3,(H,2,3,4)