1-ethyl-4-[2-(3-methyl-4-nitro-phenoxy)ethyl]piperazine-1,4-diium

Systemtic Name: 1-ethyl-4-[2-(3-methyl-4-nitro-phenoxy)ethyl]piperazine-1,4-diium Openeye Name: 1-ethyl-4-[2-(3-methyl-4-nitro-phenoxy)ethyl]piperazine-1,4-diium CAS Name: 1-ethyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine-1,4-diium IUPAC Name: 1-ethyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine-1,4-diium Traditional Name: 1-ethyl-4-[2-(3-methyl-4-nitro-phenoxy)ethyl]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)CCOC2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCOC2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

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