2-methoxy-N-[1,1,1-tris(fluoranyl)-4-phenyl-but-3-yn-2-yl]aniline

Systemtic Name: 2-methoxy-N-[1,1,1-tris(fluoranyl)-4-phenyl-but-3-yn-2-yl]aniline Openeye Name: 2-methoxy-N-[3-phenyl-1-(trifluoromethyl)prop-2-ynyl]aniline CAS Name: 2-methoxy-N-(1,1,1-trifluoro-4-phenylbut-3-yn-2-yl)aniline IUPAC Name: 2-methoxy-N-(1,1,1-trifluoro-4-phenylbut-3-yn-2-yl)aniline Traditional Name: (2-methoxyphenyl)-[3-phenyl-1-(trifluoromethyl)prop-2-ynyl]amine Formula: C17H14F3NO MolecularWeight: 305.29437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(C#CC2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

COC1=CC=CC=C1NC(C#CC2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C17H14F3NO/c1-22-15-10-6-5-9-14(15)21-16(17(18,19)20)12-11-13-7-3-2-4-8-13/h2-10,16,21H,1H3