2-(2,4-dinitrophenyl)sulfanyl-4,5-dihydro-1H-imidazol-3-ium

Systemtic Name: 2-(2,4-dinitrophenyl)sulfanyl-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 2-(2,4-dinitrophenyl)sulfanyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 2-[(2,4-dinitrophenyl)thio]-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 2-(2,4-dinitrophenyl)sulfanyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 2-[(2,4-dinitrophenyl)thio]-2-imidazolin-1-ium Formula: C9H9N4O4S+ MolecularWeight: 269.25716

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]=C(N1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C[NH+]=C(N1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H8N4O4S/c14-12(15)6-1-2-8(7(5-6)13(16)17)18-9-10-3-4-11-9/h1-2,5H,3-4H2,(H,10,11)/p+1