3-(5-phenylfuran-2-yl)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(5-phenylfuran-2-yl)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(5-phenyl-2-furyl)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(5-phenyl-2-furanyl)-1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(5-phenylfuran-2-yl)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(5-phenyl-2-furyl)-1-(4-pyridin-1-ium-2-ylpiperazino)propan-1-one Formula: C22H24N3O2+ MolecularWeight: 362.44486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCC3=CC=C(O3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCC3=CC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2/c26-22(25-16-14-24(15-17-25)21-8-4-5-13-23-21)12-10-19-9-11-20(27-19)18-6-2-1-3-7-18/h1-9,11,13H,10,12,14-17H2/p+1