N-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: N-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: N-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: N-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: [2,6-dinitro-4-(trifluoromethyl)phenyl]-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]amine Formula: C19H20F3N3O5 MolecularWeight: 427.37441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCNC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCNC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H20F3N3O5/c1-11(2)14-5-4-12(3)8-17(14)30-7-6-23-18-15(24(26)27)9-13(19(20,21)22)10-16(18)25(28)29/h4-5,8-11,23H,6-7H2,1-3H3