(4-dodecylphenyl)methyl-dimethyl-(2-prop-2-enoyloxyethyl)azanium chloride

Systemtic Name: (4-dodecylphenyl)methyl-dimethyl-(2-prop-2-enoyloxyethyl)azanium chloride Openeye Name: (4-dodecylphenyl)methyl-dimethyl-(2-prop-2-enoyloxyethyl)ammonium chloride CAS Name: (4-dodecylphenyl)methyl-dimethyl-[2-(1-oxoprop-2-enoxy)ethyl]ammonium chloride IUPAC Name: (4-dodecylphenyl)methyl-dimethyl-(2-prop-2-enoyloxyethyl)azanium chloride Traditional Name: 2-acryloyloxyethyl-(4-laurylbenzyl)-dimethyl-ammonium chloride Formula: C26H44ClNO2 MolecularWeight: 438.08606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C[N+](C)(C)CCOC(=O)C=C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C[N+](C)(C)CCOC(=O)C=C.[Cl-]

InChI

InChI=1S/C26H44NO2.ClH/c1-5-7-8-9-10-11-12-13-14-15-16-24-17-19-25(20-18-24)23-27(3,4)21-22-29-26(28)6-2;/h6,17-20H,2,5,7-16,21-23H2,1,3-4H3;1H/q+1;/p-1