N-(1-chloroethyl)-N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: N-(1-chloroethyl)-N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: N-(1-chloroethyl)-N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: N-(1-chloroethyl)-N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: N-(1-chloroethyl)-N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: 1-chloroethyl-[2,6-dinitro-4-(trifluoromethyl)phenyl]-methyl-amine Formula: C10H9ClF3N3O4 MolecularWeight: 327.64437

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9ClF3N3O4/c1-5(11)15(2)9-7(16(18)19)3-6(10(12,13)14)4-8(9)17(20)21/h3-5H,1-2H3