4-[[5-phenethyl-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]methyl]benzaldehyde

Systemtic Name: 4-[[5-phenethyl-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]methyl]benzaldehyde Openeye Name: 4-[[5-phenethyl-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]methyl]benzaldehyde CAS Name: 4-[[5-phenethyl-3-[4-(trifluoromethyl)phenyl]-1-pyrazolyl]methyl]benzaldehyde IUPAC Name: 4-[[5-phenethyl-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]methyl]benzaldehyde Traditional Name: 4-[[5-phenethyl-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]methyl]benzaldehyde Formula: C26H21F3N2O MolecularWeight: 434.45295

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC(=NN2CC3=CC=C(C=C3)C=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC(=NN2CC3=CC=C(C=C3)C=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C26H21F3N2O/c27-26(28,29)23-13-11-22(12-14-23)25-16-24(15-10-19-4-2-1-3-5-19)31(30-25)17-20-6-8-21(18-32)9-7-20/h1-9,11-14,16,18H,10,15,17H2