1-(2-methylprop-2-enoylamino)propyl-octadecan-3-yl-azanium chloride

Systemtic Name: 1-(2-methylprop-2-enoylamino)propyl-octadecan-3-yl-azanium chloride Openeye Name: 1-ethylhexadecyl-[1-(2-methylprop-2-enoylamino)propyl]ammonium chloride CAS Name: 1-[(2-methyl-1-oxoprop-2-enyl)amino]propyl-octadecan-3-ylammonium chloride IUPAC Name: 1-(2-methylprop-2-enoylamino)propyl-octadecan-3-ylazanium chloride Traditional Name: 1-ethylhexadecyl(1-methacrylamidopropyl)ammonium chloride Formula: C25H51ClN2O MolecularWeight: 431.13824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC)[NH2+]C(CC)NC(=O)C(=C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(CC)[NH2+]C(CC)NC(=O)C(=C)C.[Cl-]

InChI

InChI=1S/C25H50N2O.ClH/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-21-23(7-2)26-24(8-3)27-25(28)22(4)5;/h23-24,26H,4,6-21H2,1-3,5H3,(H,27,28);1H