N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1-pyrazol-1-yl-propan-2-amine

Systemtic Name: N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1-pyrazol-1-yl-propan-2-amine Openeye Name: N-[(2,4-difluoro-5-nitro-phenyl)methyl]-1-pyrazol-1-yl-propan-2-amine CAS Name: N-[(2,4-difluoro-5-nitrophenyl)methyl]-1-(1-pyrazolyl)-2-propanamine IUPAC Name: N-[(2,4-difluoro-5-nitrophenyl)methyl]-1-pyrazol-1-ylpropan-2-amine Traditional Name: (2,4-difluoro-5-nitro-benzyl)-(1-methyl-2-pyrazol-1-yl-ethyl)amine Formula: C13H14F2N4O2 MolecularWeight: 296.272666

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=CC=N1)NCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

Isomeric SMILES

CC(CN1C=CC=N1)NCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H14F2N4O2/c1-9(8-18-4-2-3-17-18)16-7-10-5-13(19(20)21)12(15)6-11(10)14/h2-6,9,16H,7-8H2,1H3