N-[(2-chloranyl-6-phenoxy-phenyl)methyl]-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[(2-chloranyl-6-phenoxy-phenyl)methyl]-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: N-[(2-chloro-6-phenoxy-phenyl)methyl]-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: N-[(2-chloro-6-phenoxyphenyl)methyl]-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: N-[(2-chloro-6-phenoxyphenyl)methyl]-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: (2-chloro-6-phenoxy-benzyl)-[2,6-dinitro-4-(trifluoromethyl)phenyl]amine Formula: C20H13ClF3N3O5 MolecularWeight: 467.78253

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)CNC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)CNC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H13ClF3N3O5/c21-15-7-4-8-18(32-13-5-2-1-3-6-13)14(15)11-25-19-16(26(28)29)9-12(20(22,23)24)10-17(19)27(30)31/h1-10,25H,11H2