2-(3-ethanoyl-2-methyl-indolizin-1-yl)propyl-dimethyl-pentyl-azanium bromide

Systemtic Name: 2-(3-ethanoyl-2-methyl-indolizin-1-yl)propyl-dimethyl-pentyl-azanium bromide Openeye Name: 2-(3-acetyl-2-methyl-indolizin-1-yl)propyl-dimethyl-pentyl-ammonium bromide CAS Name: 2-(3-acetyl-2-methyl-1-indolizinyl)propyl-dimethyl-pentylammonium bromide IUPAC Name: 2-(3-acetyl-2-methylindolizin-1-yl)propyl-dimethyl-pentylazanium bromide Traditional Name: 2-(3-acetyl-2-methyl-indolizin-1-yl)propyl-amyl-dimethyl-ammonium bromide Formula: C21H33BrN2O MolecularWeight: 409.40352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](C)(C)CC(C)C1=C2C=CC=CN2C(=C1C)C(=O)C.[Br-]

Isomeric SMILES

CCCCC[N+](C)(C)CC(C)C1=C2C=CC=CN2C(=C1C)C(=O)C.[Br-]

InChI

InChI=1S/C21H33N2O.BrH/c1-7-8-11-14-23(5,6)15-16(2)20-17(3)21(18(4)24)22-13-10-9-12-19(20)22;/h9-10,12-13,16H,7-8,11,14-15H2,1-6H3;1H/q+1;/p-1