2-(2-cyclohexyl-4-methyl-3-oxidanyl-pentanoyl)oxyethyl-diethyl-methyl-azanium bromide

Systemtic Name: 2-(2-cyclohexyl-4-methyl-3-oxidanyl-pentanoyl)oxyethyl-diethyl-methyl-azanium bromide Openeye Name: 2-(2-cyclohexyl-3-hydroxy-4-methyl-pentanoyl)oxyethyl-diethyl-methyl-ammonium bromide CAS Name: 2-(2-cyclohexyl-3-hydroxy-4-methyl-1-oxopentoxy)ethyl-diethyl-methylammonium bromide IUPAC Name: 2-(2-cyclohexyl-3-hydroxy-4-methylpentanoyl)oxyethyl-diethyl-methylazanium bromide Traditional Name: 2-(2-cyclohexyl-3-hydroxy-4-methyl-pentanoyl)oxyethyl-diethyl-methyl-ammonium bromide Formula: C19H38BrNO3 MolecularWeight: 408.41392

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)C(C(C)C)O.[Br-]

Isomeric SMILES

CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)C(C(C)C)O.[Br-]

InChI

InChI=1S/C19H38NO3.BrH/c1-6-20(5,7-2)13-14-23-19(22)17(18(21)15(3)4)16-11-9-8-10-12-16;/h15-18,21H,6-14H2,1-5H3;1H/q+1;/p-1