3-[4-phenyl-1-(trifluoromethyl)cyclohexa-2,5-dien-1-yl]propanal

Systemtic Name: 3-[4-phenyl-1-(trifluoromethyl)cyclohexa-2,5-dien-1-yl]propanal Openeye Name: 3-[4-phenyl-1-(trifluoromethyl)cyclohexa-2,5-dien-1-yl]propanal CAS Name: 3-[4-phenyl-1-(trifluoromethyl)-1-cyclohexa-2,5-dienyl]propanal IUPAC Name: 3-[4-phenyl-1-(trifluoromethyl)cyclohexa-2,5-dien-1-yl]propanal Traditional Name: 3-[4-phenyl-1-(trifluoromethyl)cyclohexa-2,5-dien-1-yl]propionaldehyde Formula: C16H15F3O MolecularWeight: 280.28491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(C=C2)(CCC=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2C=CC(C=C2)(CCC=O)C(F)(F)F

InChI

InChI=1S/C16H15F3O/c17-16(18,19)15(9-4-12-20)10-7-14(8-11-15)13-5-2-1-3-6-13/h1-3,5-8,10-12,14H,4,9H2