2-(5-azanyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(4-bromophenyl)ethanone

Systemtic Name: 2-(5-azanyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(4-bromophenyl)ethanone Openeye Name: 2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(4-bromophenyl)ethanone CAS Name: 2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(4-bromophenyl)ethanone IUPAC Name: 2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(4-bromophenyl)ethanone Traditional Name: 2-(2-amino-1-pyrrolin-1-ium-1-yl)-1-(4-bromophenyl)ethanone Formula: C12H14BrN2O+ MolecularWeight: 282.15636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[N+](C1)CC(=O)C2=CC=C(C=C2)Br)N

Isomeric SMILES

C1CC(=[N+](C1)CC(=O)C2=CC=C(C=C2)Br)N

InChI

InChI=1S/C12H13BrN2O/c13-10-5-3-9(4-6-10)11(16)8-15-7-1-2-12(15)14/h3-6,14H,1-2,7-8H2/p+1