(2-acetyloxycyclohexyl)-tetradecan-3-yl-azanium bromide

Systemtic Name: (2-acetyloxycyclohexyl)-tetradecan-3-yl-azanium bromide Openeye Name: (2-acetoxycyclohexyl)-(1-ethyldodecyl)ammonium bromide CAS Name: (2-acetyloxycyclohexyl)-tetradecan-3-ylammonium bromide IUPAC Name: (2-acetyloxycyclohexyl)-tetradecan-3-ylazanium bromide Traditional Name: (2-acetoxycyclohexyl)-(1-ethyldodecyl)ammonium bromide Formula: C22H44BrNO2 MolecularWeight: 434.49426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC)[NH2+]C1CCCCC1OC(=O)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCC(CC)[NH2+]C1CCCCC1OC(=O)C.[Br-]

InChI

InChI=1S/C22H43NO2.BrH/c1-4-6-7-8-9-10-11-12-13-16-20(5-2)23-21-17-14-15-18-22(21)25-19(3)24;/h20-23H,4-18H2,1-3H3;1H