4-ethyl-3-(1H-imidazol-2-yl)-4-methyl-5-nitro-6-thia-2-aza-4-azoniabicyclo[3.1.0]hex-1-ene

Systemtic Name: 4-ethyl-3-(1H-imidazol-2-yl)-4-methyl-5-nitro-6-thia-2-aza-4-azoniabicyclo[3.1.0]hex-1-ene Openeye Name: 4-ethyl-3-(1H-imidazol-2-yl)-4-methyl-5-nitro-6-thia-2-aza-4-azoniabicyclo[3.1.0]hex-1-ene CAS Name: 4-ethyl-3-(1H-imidazol-2-yl)-4-methyl-5-nitro-6-thia-2-aza-4-azoniabicyclo[3.1.0]hex-1-ene IUPAC Name: 4-ethyl-3-(1H-imidazol-2-yl)-4-methyl-5-nitro-6-thia-2-aza-4-azoniabicyclo[3.1.0]hex-1-ene Traditional Name: 4-ethyl-3-(1H-imidazol-2-yl)-4-methyl-5-nitro-6-thia-2-aza-4-azoniabicyclo[3.1.0]hex-1-ene Formula: C9H12N5O2S+ MolecularWeight: 254.28888

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(N=C2C1(S2)[N+](=O)[O-])C3=NC=CN3)C

Isomeric SMILES

CC[N+]1(C(N=C2C1(S2)[N+](=O)[O-])C3=NC=CN3)C

InChI

InChI=1S/C9H12N5O2S/c1-3-14(2)7(6-10-4-5-11-6)12-8-9(14,17-8)13(15)16/h4-5,7H,3H2,1-2H3,(H,10,11)/q+1