N-butyl-N-ethyl-3,5-bis(fluoranyl)-4-(fluoranylmethyl)-2,6-dinitro-aniline

Systemtic Name: N-butyl-N-ethyl-3,5-bis(fluoranyl)-4-(fluoranylmethyl)-2,6-dinitro-aniline Openeye Name: N-butyl-N-ethyl-3,5-difluoro-4-(fluoromethyl)-2,6-dinitro-aniline CAS Name: N-butyl-N-ethyl-3,5-difluoro-4-(fluoromethyl)-2,6-dinitroaniline IUPAC Name: N-butyl-N-ethyl-3,5-difluoro-4-(fluoromethyl)-2,6-dinitroaniline Traditional Name: butyl-[3,5-difluoro-4-(fluoromethyl)-2,6-dinitro-phenyl]-ethyl-amine Formula: C13H16F3N3O4 MolecularWeight: 335.27905

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=C(C(=C(C(=C1[N+](=O)[O-])F)CF)F)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC)C1=C(C(=C(C(=C1[N+](=O)[O-])F)CF)F)[N+](=O)[O-]

InChI

InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)13-11(18(20)21)9(15)8(7-14)10(16)12(13)19(22)23/h3-7H2,1-2H3