N-[[3,4-bis(fluoranyl)phenyl]methyl]-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[[3,4-bis(fluoranyl)phenyl]methyl]-3-nitro-pyridin-1-ium-2-amine Openeye Name: N-[(3,4-difluorophenyl)methyl]-3-nitro-pyridin-1-ium-2-amine CAS Name: N-[(3,4-difluorophenyl)methyl]-3-nitro-2-pyridin-1-iumamine IUPAC Name: N-[(3,4-difluorophenyl)methyl]-3-nitropyridin-1-ium-2-amine Traditional Name: (3,4-difluorobenzyl)-(3-nitropyridin-1-ium-2-yl)amine Formula: C12H10F2N3O2+ MolecularWeight: 266.223506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C([NH+]=C1)NCC2=CC(=C(C=C2)F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C([NH+]=C1)NCC2=CC(=C(C=C2)F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H9F2N3O2/c13-9-4-3-8(6-10(9)14)7-16-12-11(17(18)19)2-1-5-15-12/h1-6H,7H2,(H,15,16)/p+1