bis(but-2-ynyl)-methyl-phenacyl-azanium bromide

Systemtic Name: bis(but-2-ynyl)-methyl-phenacyl-azanium bromide Openeye Name: bis(but-2-ynyl)-methyl-phenacyl-ammonium bromide CAS Name: bis(but-2-ynyl)-methyl-phenacylammonium bromide IUPAC Name: bis(but-2-ynyl)-methyl-phenacylazanium bromide Traditional Name: bis(but-2-ynyl)-methyl-phenacyl-ammonium bromide Formula: C17H20BrNO MolecularWeight: 334.2508

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC[N+](C)(CC#CC)CC(=O)C1=CC=CC=C1.[Br-]

Isomeric SMILES

CC#CC[N+](C)(CC#CC)CC(=O)C1=CC=CC=C1.[Br-]

InChI

InChI=1S/C17H20NO.BrH/c1-4-6-13-18(3,14-7-5-2)15-17(19)16-11-9-8-10-12-16;/h8-12H,13-15H2,1-3H3;1H/q+1;/p-1