trimethyl-[6-methyl-6-(prop-2-enoylamino)heptan-3-yl]azanium bromide

Systemtic Name: trimethyl-[6-methyl-6-(prop-2-enoylamino)heptan-3-yl]azanium bromide Openeye Name: [1-ethyl-4-methyl-4-(prop-2-enoylamino)pentyl]-trimethyl-ammonium bromide CAS Name: trimethyl-[6-methyl-6-(1-oxoprop-2-enylamino)heptan-3-yl]ammonium bromide IUPAC Name: trimethyl-[6-methyl-6-(prop-2-enoylamino)heptan-3-yl]azanium bromide Traditional Name: (4-acrylamido-1-ethyl-4-methyl-pentyl)-trimethyl-ammonium bromide Formula: C14H29BrN2O MolecularWeight: 321.29686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C)(C)NC(=O)C=C)[N+](C)(C)C.[Br-]

Isomeric SMILES

CCC(CCC(C)(C)NC(=O)C=C)[N+](C)(C)C.[Br-]

InChI

InChI=1S/C14H28N2O.BrH/c1-8-12(16(5,6)7)10-11-14(3,4)15-13(17)9-2;/h9,12H,2,8,10-11H2,1,3-7H3;1H