[2,6-bis(fluoranyl)phenyl]methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [2,6-bis(fluoranyl)phenyl]methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: (2,6-difluorophenyl)methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: (2,6-difluorophenyl)methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: (2,6-difluorophenyl)methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: (2,6-difluorobenzyl)-(3-imidazol-1-ylpropyl)ammonium Formula: C13H16F2N3+ MolecularWeight: 252.283046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)C[NH2+]CCCN2C=CN=C2)F

Isomeric SMILES

C1=CC(=C(C(=C1)F)C[NH2+]CCCN2C=CN=C2)F

InChI

InChI=1S/C13H15F2N3/c14-12-3-1-4-13(15)11(12)9-16-5-2-7-18-8-6-17-10-18/h1,3-4,6,8,10,16H,2,5,7,9H2/p+1