6-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Openeye Name: 6-[1-[(E)-3-(4-fluorophenyl)allyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one CAS Name: 6-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-4-piperidin-1-iumyl]-1H-pyrimidin-4-one IUPAC Name: 6-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Traditional Name: 6-[1-[(E)-3-(4-fluorophenyl)allyl]piperidin-1-ium-4-yl]-1H-pyrimidin-4-one Formula: C18H21FN3O+ MolecularWeight: 314.377243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CC(=O)N=CN2)CC=CC3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCC1C2=CC(=O)N=CN2)C/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN3O/c19-16-5-3-14(4-6-16)2-1-9-22-10-7-15(8-11-22)17-12-18(23)21-13-20-17/h1-6,12-13,15H,7-11H2,(H,20,21,23)/p+1/b2-1+