N-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-trinitro-aniline

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-trinitro-aniline Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-trinitro-aniline CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-trinitroaniline IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-trinitroaniline Traditional Name: [3,5-bis(trifluoromethyl)phenyl]-picryl-amine Formula: C14H6F6N4O6 MolecularWeight: 440.211059

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C14H6F6N4O6/c15-13(16,17)6-1-7(14(18,19)20)3-8(2-6)21-12-10(23(27)28)4-9(22(25)26)5-11(12)24(29)30/h1-5,21H