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

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-bromo-2-fluoro-phenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (5-bromo-2-fluorophenyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-bromo-2-fluorophenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-bromo-2-fluoro-phenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C19H21BrFN2O+ MolecularWeight: 392.285243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C19H20BrFN2O/c20-16-6-7-18(21)17(14-16)19(24)23-12-10-22(11-13-23)9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2/p+1