N-[3,5-bis(trifluoromethyl)phenyl]-4-ethyl-2,6-dinitro-aniline

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-ethyl-2,6-dinitro-aniline Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-ethyl-2,6-dinitro-aniline CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-ethyl-2,6-dinitroaniline IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-ethyl-2,6-dinitroaniline Traditional Name: [3,5-bis(trifluoromethyl)phenyl]-(4-ethyl-2,6-dinitro-phenyl)amine Formula: C16H11F6N3O4 MolecularWeight: 423.266659

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)[N+](=O)[O-])NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=C(C(=C1)[N+](=O)[O-])NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H11F6N3O4/c1-2-8-3-12(24(26)27)14(13(4-8)25(28)29)23-11-6-9(15(17,18)19)5-10(7-11)16(20,21)22/h3-7,23H,2H2,1H3