(4-bromanylthiophen-2-yl)-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (4-bromanylthiophen-2-yl)-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (4-bromo-2-thienyl)-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (4-bromo-2-thiophenyl)-[4-[(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (4-bromothiophen-2-yl)-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (4-bromo-2-thienyl)-[4-(4-fluorobenzyl)piperazin-4-ium-1-yl]methanone Formula: C16H17BrFN2OS+ MolecularWeight: 384.286383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)F)C(=O)C3=CC(=CS3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)F)C(=O)C3=CC(=CS3)Br

InChI

InChI=1S/C16H16BrFN2OS/c17-13-9-15(22-11-13)16(21)20-7-5-19(6-8-20)10-12-1-3-14(18)4-2-12/h1-4,9,11H,5-8,10H2/p+1