3-[2-(4-nitrophenyl)ethynyl]-2-(trifluoromethyl)aniline

Systemtic Name: 3-[2-(4-nitrophenyl)ethynyl]-2-(trifluoromethyl)aniline Openeye Name: 3-[2-(4-nitrophenyl)ethynyl]-2-(trifluoromethyl)aniline CAS Name: 3-[2-(4-nitrophenyl)ethynyl]-2-(trifluoromethyl)aniline IUPAC Name: 3-[2-(4-nitrophenyl)ethynyl]-2-(trifluoromethyl)aniline Traditional Name: [3-[2-(4-nitrophenyl)ethynyl]-2-(trifluoromethyl)phenyl]amine Formula: C15H9F3N2O2 MolecularWeight: 306.23937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)N)C(F)(F)F)C#CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)N)C(F)(F)F)C#CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H9F3N2O2/c16-15(17,18)14-11(2-1-3-13(14)19)7-4-10-5-8-12(9-6-10)20(21)22/h1-3,5-6,8-9H,19H2