ethyl-[[methyl(prop-2-enoyl)amino]methyl]-(2-methylpropyl)-octadecyl-azanium

Systemtic Name: ethyl-[[methyl(prop-2-enoyl)amino]methyl]-(2-methylpropyl)-octadecyl-azanium Openeye Name: ethyl-isobutyl-[[methyl(prop-2-enoyl)amino]methyl]-octadecyl-ammonium CAS Name: ethyl-[[methyl(1-oxoprop-2-enyl)amino]methyl]-(2-methylpropyl)-octadecylammonium IUPAC Name: ethyl-[[methyl(prop-2-enoyl)amino]methyl]-(2-methylpropyl)-octadecylazanium Traditional Name: [acryloyl(methyl)amino]methyl-ethyl-isobutyl-stearyl-ammonium Formula: C29H59N2O+ MolecularWeight: 451.79156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](CC)(CC(C)C)CN(C)C(=O)C=C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](CC)(CC(C)C)CN(C)C(=O)C=C

InChI

InChI=1S/C29H59N2O/c1-7-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-31(9-3,26-28(4)5)27-30(6)29(32)8-2/h8,28H,2,7,9-27H2,1,3-6H3/q+1