2-[[4-chloranyl-2-(trifluoromethyl)quinolin-6-yl]methyl-prop-2-ynyl-amino]benzaldehyde

Systemtic Name: 2-[[4-chloranyl-2-(trifluoromethyl)quinolin-6-yl]methyl-prop-2-ynyl-amino]benzaldehyde Openeye Name: 2-[[4-chloro-2-(trifluoromethyl)-6-quinolyl]methyl-prop-2-ynyl-amino]benzaldehyde CAS Name: 2-[[4-chloro-2-(trifluoromethyl)-6-quinolinyl]methyl-prop-2-ynylamino]benzaldehyde IUPAC Name: 2-[[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl-prop-2-ynylamino]benzaldehyde Traditional Name: 2-[[4-chloro-2-(trifluoromethyl)-6-quinolyl]methyl-propargyl-amino]benzaldehyde Formula: C21H14ClF3N2O MolecularWeight: 402.79687

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC1=CC2=C(C=C1)N=C(C=C2Cl)C(F)(F)F)C3=CC=CC=C3C=O

Isomeric SMILES

C#CCN(CC1=CC2=C(C=C1)N=C(C=C2Cl)C(F)(F)F)C3=CC=CC=C3C=O

InChI

InChI=1S/C21H14ClF3N2O/c1-2-9-27(19-6-4-3-5-15(19)13-28)12-14-7-8-18-16(10-14)17(22)11-20(26-18)21(23,24)25/h1,3-8,10-11,13H,9,12H2