1-[(5-bromanylfuran-2-yl)methyl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[(5-bromanylfuran-2-yl)methyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(5-bromo-2-furyl)methyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[(5-bromo-2-furanyl)methyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(5-bromofuran-2-yl)methyl]-4-phenylpiperazin-1-ium Traditional Name: 1-[(5-bromo-2-furyl)methyl]-4-phenyl-piperazin-1-ium Formula: C15H18BrN2O+ MolecularWeight: 322.22022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(O2)Br)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(O2)Br)C3=CC=CC=C3

InChI

InChI=1S/C15H17BrN2O/c16-15-7-6-14(19-15)12-17-8-10-18(11-9-17)13-4-2-1-3-5-13/h1-7H,8-12H2/p+1