4-chloranyl-N-[[3-phenyl-7-(trifluoromethyl)quinoxalin-2-yl]methyl]-N-prop-2-ynyl-aniline

Systemtic Name: 4-chloranyl-N-[[3-phenyl-7-(trifluoromethyl)quinoxalin-2-yl]methyl]-N-prop-2-ynyl-aniline Openeye Name: 4-chloro-N-[[3-phenyl-7-(trifluoromethyl)quinoxalin-2-yl]methyl]-N-prop-2-ynyl-aniline CAS Name: 4-chloro-N-[[3-phenyl-7-(trifluoromethyl)-2-quinoxalinyl]methyl]-N-prop-2-ynylaniline IUPAC Name: 4-chloro-N-[[3-phenyl-7-(trifluoromethyl)quinoxalin-2-yl]methyl]-N-prop-2-ynylaniline Traditional Name: (4-chlorophenyl)-[[3-phenyl-7-(trifluoromethyl)quinoxalin-2-yl]methyl]-propargyl-amine Formula: C25H17ClF3N3 MolecularWeight: 451.87079

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC1=NC2=C(C=CC(=C2)C(F)(F)F)N=C1C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C#CCN(CC1=NC2=C(C=CC(=C2)C(F)(F)F)N=C1C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H17ClF3N3/c1-2-14-32(20-11-9-19(26)10-12-20)16-23-24(17-6-4-3-5-7-17)31-21-13-8-18(25(27,28)29)15-22(21)30-23/h1,3-13,15H,14,16H2