5-fluoranyl-2,4-dinitro-N-(phenylmethyl)aniline

Systemtic Name: 5-fluoranyl-2,4-dinitro-N-(phenylmethyl)aniline Openeye Name: N-benzyl-5-fluoro-2,4-dinitro-aniline CAS Name: 5-fluoro-2,4-dinitro-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-5-fluoro-2,4-dinitroaniline Traditional Name: benzyl-(5-fluoro-2,4-dinitro-phenyl)amine Formula: C13H10FN3O4 MolecularWeight: 291.234603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C13H10FN3O4/c14-10-6-11(15-8-9-4-2-1-3-5-9)13(17(20)21)7-12(10)16(18)19/h1-7,15H,8H2