N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1-pyridin-3-yl-methanamine

Systemtic Name: N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1-pyridin-3-yl-methanamine Openeye Name: N-[(2,4-difluoro-5-nitro-phenyl)methyl]-1-(3-pyridyl)methanamine CAS Name: N-[(2,4-difluoro-5-nitrophenyl)methyl]-1-(3-pyridinyl)methanamine IUPAC Name: N-[(2,4-difluoro-5-nitrophenyl)methyl]-1-pyridin-3-ylmethanamine Traditional Name: (2,4-difluoro-5-nitro-benzyl)-(3-pyridylmethyl)amine Formula: C13H11F2N3O2 MolecularWeight: 279.242146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)CNCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H11F2N3O2/c14-11-5-12(15)13(18(19)20)4-10(11)8-17-7-9-2-1-3-16-6-9/h1-6,17H,7-8H2