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

Systemtic Name: 2-bromanyl-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-6-fluoranyl-4-methyl-aniline Openeye Name: 2-bromo-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-6-fluoro-4-methyl-aniline CAS Name: 2-bromo-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-6-fluoro-4-methylaniline IUPAC Name: 2-bromo-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-6-fluoro-4-methylaniline Traditional Name: (2-bromo-6-fluoro-4-methyl-phenyl)-[2,4-dinitro-6-(trifluoromethyl)phenyl]amine Formula: C14H8BrF4N3O4 MolecularWeight: 438.128633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C14H8BrF4N3O4/c1-6-2-9(15)13(10(16)3-6)20-12-8(14(17,18)19)4-7(21(23)24)5-11(12)22(25)26/h2-5,20H,1H3