N-[(3-fluorophenyl)methyl]-N,3-dimethyl-imidazol-3-ium-1-carboxamide

Systemtic Name: N-[(3-fluorophenyl)methyl]-N,3-dimethyl-imidazol-3-ium-1-carboxamide Openeye Name: N-[(3-fluorophenyl)methyl]-N,3-dimethyl-imidazol-3-ium-1-carboxamide CAS Name: N-[(3-fluorophenyl)methyl]-N,3-dimethyl-1-imidazol-3-iumcarboxamide IUPAC Name: N-[(3-fluorophenyl)methyl]-N,3-dimethylimidazol-3-ium-1-carboxamide Traditional Name: N-(3-fluorobenzyl)-N,3-dimethyl-imidazol-3-ium-1-carboxamide Formula: C13H15FN3O+ MolecularWeight: 248.276103

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)C(=O)N(C)CC2=CC(=CC=C2)F

Isomeric SMILES

C[N+]1=CN(C=C1)C(=O)N(C)CC2=CC(=CC=C2)F

InChI

InChI=1S/C13H15FN3O/c1-15-6-7-17(10-15)13(18)16(2)9-11-4-3-5-12(14)8-11/h3-8,10H,9H2,1-2H3/q+1