1-[(3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-3-pyridin-3-yl-propan-1-one

Systemtic Name: 1-[(3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-3-pyridin-3-yl-propan-1-one Openeye Name: 1-[(3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-piperidyl]-3-(3-pyridyl)propan-1-one CAS Name: 1-[(3S)-3-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-1-piperidinyl]-3-(3-pyridinyl)-1-propanone IUPAC Name: 1-[(3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-3-pyridin-3-ylpropan-1-one Traditional Name: 1-[(3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]piperidino]-3-(3-pyridyl)propan-1-one Formula: C23H30FN4O+ MolecularWeight: 397.508903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CCC2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H29FN4O/c24-20-6-8-21(9-7-20)26-13-15-27(16-14-26)22-4-2-12-28(18-22)23(29)10-5-19-3-1-11-25-17-19/h1,3,6-9,11,17,22H,2,4-5,10,12-16,18H2/p+1/t22-/m0/s1