1-ethyl-4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-ium

Systemtic Name: 1-ethyl-4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-ium Openeye Name: 1-ethyl-4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-ium CAS Name: 1-ethyl-4-(3-methyl-5-nitro-4-imidazolyl)piperazin-1-ium IUPAC Name: 1-ethyl-4-(3-methyl-5-nitroimidazol-4-yl)piperazin-1-ium Traditional Name: 1-ethyl-4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-ium Formula: C10H18N5O2+ MolecularWeight: 240.28222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(N=CN2C)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(N=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C10H17N5O2/c1-3-13-4-6-14(7-5-13)10-9(15(16)17)11-8-12(10)2/h8H,3-7H2,1-2H3/p+1