N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1,3,5-trimethyl-pyrazol-4-amine

Systemtic Name: N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1,3,5-trimethyl-pyrazol-4-amine Openeye Name: N-[(2,4-difluoro-5-nitro-phenyl)methyl]-1,3,5-trimethyl-pyrazol-4-amine CAS Name: N-[(2,4-difluoro-5-nitrophenyl)methyl]-1,3,5-trimethyl-4-pyrazolamine IUPAC Name: N-[(2,4-difluoro-5-nitrophenyl)methyl]-1,3,5-trimethylpyrazol-4-amine Traditional Name: (2,4-difluoro-5-nitro-benzyl)-(1,3,5-trimethylpyrazol-4-yl)amine Formula: C13H14F2N4O2 MolecularWeight: 296.272666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)NCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H14F2N4O2/c1-7-13(8(2)18(3)17-7)16-6-9-4-12(19(20)21)11(15)5-10(9)14/h4-5,16H,6H2,1-3H3