7-[bis(fluoranyl)methyl]-5-phenyl-2,3-dihydro-1H-1,4-diazepin-1-ium

Systemtic Name: 7-[bis(fluoranyl)methyl]-5-phenyl-2,3-dihydro-1H-1,4-diazepin-1-ium Openeye Name: 7-(difluoromethyl)-5-phenyl-2,3-dihydro-1H-1,4-diazepin-1-ium CAS Name: 7-(difluoromethyl)-5-phenyl-2,3-dihydro-1H-1,4-diazepin-1-ium IUPAC Name: 7-(difluoromethyl)-5-phenyl-2,3-dihydro-1H-1,4-diazepin-1-ium Traditional Name: 7-(difluoromethyl)-5-phenyl-2,3-dihydro-1H-1,4-diazepin-1-ium Formula: C12H13F2N2+ MolecularWeight: 223.241826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C=C([NH2+]1)C(F)F)C2=CC=CC=C2

Isomeric SMILES

C1CN=C(C=C([NH2+]1)C(F)F)C2=CC=CC=C2

InChI

InChI=1S/C12H12F2N2/c13-12(14)11-8-10(15-6-7-16-11)9-4-2-1-3-5-9/h1-5,8,12,16H,6-7H2/p+1