1-[[4-(3-fluoranylpropoxy)phenyl]methyl]-4-(4-nitrophenyl)piperazin-1-ium

Systemtic Name: 1-[[4-(3-fluoranylpropoxy)phenyl]methyl]-4-(4-nitrophenyl)piperazin-1-ium Openeye Name: 1-[[4-(3-fluoropropoxy)phenyl]methyl]-4-(4-nitrophenyl)piperazin-1-ium CAS Name: 1-[[4-(3-fluoropropoxy)phenyl]methyl]-4-(4-nitrophenyl)piperazin-1-ium IUPAC Name: 1-[[4-(3-fluoropropoxy)phenyl]methyl]-4-(4-nitrophenyl)piperazin-1-ium Traditional Name: 1-[4-(3-fluoropropoxy)benzyl]-4-(4-nitrophenyl)piperazin-1-ium Formula: C20H25FN3O3+ MolecularWeight: 374.429203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24FN3O3/c21-10-1-15-27-20-8-2-17(3-9-20)16-22-11-13-23(14-12-22)18-4-6-19(7-5-18)24(25)26/h2-9H,1,10-16H2/p+1