(5-bromanyl-2-chloranyl-phenyl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-bromanyl-2-chloranyl-phenyl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (5-bromo-2-chloro-phenyl)-[4-(2-furylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (5-bromo-2-chlorophenyl)-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (5-bromo-2-chlorophenyl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (5-bromo-2-chloro-phenyl)-[4-(2-furfuryl)piperazin-4-ium-1-yl]methanone Formula: C16H17BrClN2O2+ MolecularWeight: 384.67538

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)C3=C(C=CC(=C3)Br)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)C3=C(C=CC(=C3)Br)Cl

InChI

InChI=1S/C16H16BrClN2O2/c17-12-3-4-15(18)14(10-12)16(21)20-7-5-19(6-8-20)11-13-2-1-9-22-13/h1-4,9-10H,5-8,11H2/p+1