1-(furan-3-ylmethyl)-4-(4-nitrophenyl)piperazin-1-ium

Systemtic Name: 1-(furan-3-ylmethyl)-4-(4-nitrophenyl)piperazin-1-ium Openeye Name: 1-(3-furylmethyl)-4-(4-nitrophenyl)piperazin-1-ium CAS Name: 1-(3-furanylmethyl)-4-(4-nitrophenyl)piperazin-1-ium IUPAC Name: 1-(furan-3-ylmethyl)-4-(4-nitrophenyl)piperazin-1-ium Traditional Name: 1-(3-furfuryl)-4-(4-nitrophenyl)piperazin-1-ium Formula: C15H18N3O3+ MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=COC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CC2=COC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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