2,5-bis(fluoranyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide

Systemtic Name: 2,5-bis(fluoranyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Openeye Name: 2,5-difluoro-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide CAS Name: 2,5-difluoro-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide IUPAC Name: 2,5-difluoro-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Traditional Name: 2,5-difluoro-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Formula: C14H16F2N3O+ MolecularWeight: 280.293146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=C(C1CNC(=O)C2=C(C=CC(=C2)F)F)C)C

Isomeric SMILES

CC1=N[N+](=C(C1CNC(=O)C2=C(C=CC(=C2)F)F)C)C

InChI

InChI=1S/C14H15F2N3O/c1-8-12(9(2)19(3)18-8)7-17-14(20)11-6-10(15)4-5-13(11)16/h4-6,12H,7H2,1-3H3/p+1