1-phenyl-2-(2-pyrrolidin-1-ium-1-ylidene-3,4-dihydro-1H-naphthalen-1-yl)ethanone bromide

Systemtic Name: 1-phenyl-2-(2-pyrrolidin-1-ium-1-ylidene-3,4-dihydro-1H-naphthalen-1-yl)ethanone bromide Openeye Name: 1-phenyl-2-(2-pyrrolidin-1-ium-1-ylidenetetralin-1-yl)ethanone bromide CAS Name: 1-phenyl-2-[2-(1-pyrrolidin-1-iumylidene)-3,4-dihydro-1H-naphthalen-1-yl]ethanone bromide IUPAC Name: 1-phenyl-2-(2-pyrrolidin-1-ium-1-ylidene-3,4-dihydro-1H-naphthalen-1-yl)ethanone bromide Traditional Name: 1-phenyl-2-(2-pyrrolidin-1-ium-1-ylidenetetralin-1-yl)ethanone bromide Formula: C22H24BrNO MolecularWeight: 398.33606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C2CCC3=CC=CC=C3C2CC(=O)C4=CC=CC=C4)C1.[Br-]

Isomeric SMILES

C1CC[N+](=C2CCC3=CC=CC=C3C2CC(=O)C4=CC=CC=C4)C1.[Br-]

InChI

InChI=1S/C22H24NO.BrH/c24-22(18-9-2-1-3-10-18)16-20-19-11-5-4-8-17(19)12-13-21(20)23-14-6-7-15-23;/h1-5,8-11,20H,6-7,12-16H2;1H/q+1;/p-1