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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]methanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]formamide CAS Name: N-(4-bromo-2-methylphenyl)-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]formamide IUPAC Name: N-(4-bromo-2-methylphenyl)-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]formamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]formamide Formula: C15H9BrF3N3O5 MolecularWeight: 448.14827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)N(C=O)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)N(C=O)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H9BrF3N3O5/c1-8-4-10(16)2-3-11(8)20(7-23)14-12(21(24)25)5-9(15(17,18)19)6-13(14)22(26)27/h2-7H,1H3