N-[4-bromanyl-2-(trifluoromethyl)phenyl]-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline

Systemtic Name: N-[4-bromanyl-2-(trifluoromethyl)phenyl]-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline Openeye Name: N-[4-bromo-2-(trifluoromethyl)phenyl]-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline CAS Name: N-[4-bromo-2-(trifluoromethyl)phenyl]-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline IUPAC Name: N-[4-bromo-2-(trifluoromethyl)phenyl]-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline Traditional Name: [4-bromo-2-(trifluoromethyl)phenyl]-[2,4-dinitro-6-(trifluoromethyl)phenyl]-propyl-amine Formula: C17H12BrF6N3O4 MolecularWeight: 516.189299

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=C(C=C1)Br)C(F)(F)F)C2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCN(C1=C(C=C(C=C1)Br)C(F)(F)F)C2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H12BrF6N3O4/c1-2-5-25(13-4-3-9(18)6-11(13)16(19,20)21)15-12(17(22,23)24)7-10(26(28)29)8-14(15)27(30)31/h3-4,6-8H,2,5H2,1H3