1-[5-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]piperidin-4-one

Systemtic Name: 1-[5-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]piperidin-4-one Openeye Name: 1-[5-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]piperidin-4-one CAS Name: 1-[5-[[4-(trifluoromethyl)phenyl]methyl]-4-pyrimidinyl]-4-piperidinone IUPAC Name: 1-[5-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]piperidin-4-one Traditional Name: 1-[5-[4-(trifluoromethyl)benzyl]pyrimidin-4-yl]-4-piperidone Formula: C17H16F3N3O MolecularWeight: 335.32365

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C2=NC=NC=C2CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1=O)C2=NC=NC=C2CC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H16F3N3O/c18-17(19,20)14-3-1-12(2-4-14)9-13-10-21-11-22-16(13)23-7-5-15(24)6-8-23/h1-4,10-11H,5-9H2