1-ethyl-4-[3-(4-nitrophenoxy)propyl]piperazine-1,4-diium

Systemtic Name: 1-ethyl-4-[3-(4-nitrophenoxy)propyl]piperazine-1,4-diium Openeye Name: 1-ethyl-4-[3-(4-nitrophenoxy)propyl]piperazine-1,4-diium CAS Name: 1-ethyl-4-[3-(4-nitrophenoxy)propyl]piperazine-1,4-diium IUPAC Name: 1-ethyl-4-[3-(4-nitrophenoxy)propyl]piperazine-1,4-diium Traditional Name: 1-ethyl-4-[3-(4-nitrophenoxy)propyl]piperazine-1,4-diium Formula: C15H25N3O3+2 MolecularWeight: 295.3773

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCCOC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCCOC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H23N3O3/c1-2-16-9-11-17(12-10-16)8-3-13-21-15-6-4-14(5-7-15)18(19)20/h4-7H,2-3,8-13H2,1H3/p+2