(5-bromanyl-2-fluoranyl-phenyl)-piperazin-4-ium-1-yl-methanone

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)-piperazin-4-ium-1-yl-methanone Openeye Name: (5-bromo-2-fluoro-phenyl)-piperazin-4-ium-1-yl-methanone CAS Name: (5-bromo-2-fluorophenyl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (5-bromo-2-fluorophenyl)-piperazin-4-ium-1-ylmethanone Traditional Name: (5-bromo-2-fluoro-phenyl)-piperazin-4-ium-1-yl-methanone Formula: C11H13BrFN2O+ MolecularWeight: 288.136123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=C(C=CC(=C2)Br)F

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C11H12BrFN2O/c12-8-1-2-10(13)9(7-8)11(16)15-5-3-14-4-6-15/h1-2,7,14H,3-6H2/p+1