N-(4-chlorophenyl)-1,3-dimethyl-imidazol-1-ium-4-carboximidate

Systemtic Name: N-(4-chlorophenyl)-1,3-dimethyl-imidazol-1-ium-4-carboximidate Openeye Name: N-(4-chlorophenyl)-1,3-dimethyl-imidazol-1-ium-4-carboximidate CAS Name: N-(4-chlorophenyl)-1,3-dimethyl-4-imidazol-1-iumcarboximidate IUPAC Name: N-(4-chlorophenyl)-1,3-dimethylimidazol-1-ium-4-carboximidate Traditional Name: N-(4-chlorophenyl)-1,3-dimethyl-imidazol-1-ium-4-carboximidate Formula: C12H12ClN3O MolecularWeight: 249.69618

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C=C1C(=NC2=CC=C(C=C2)Cl)[O-])C

Isomeric SMILES

CN1C=[N+](C=C1C(=NC2=CC=C(C=C2)Cl)[O-])C

InChI

InChI=1S/C12H12ClN3O/c1-15-7-11(16(2)8-15)12(17)14-10-5-3-9(13)4-6-10/h3-8H,1-2H3