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

Systemtic Name: 1-[(5-nitrofuran-2-yl)methyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(5-nitro-2-furyl)methyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[(5-nitro-2-furanyl)methyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(5-nitrofuran-2-yl)methyl]-4-phenylpiperazin-1-ium Traditional Name: 1-[(5-nitro-2-furyl)methyl]-4-phenyl-piperazin-1-ium Formula: C15H18N3O3+ MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(O2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(O2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C15H17N3O3/c19-18(20)15-7-6-14(21-15)12-16-8-10-17(11-9-16)13-4-2-1-3-5-13/h1-7H,8-12H2/p+1