(2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-indol-3-yl)propan-1-one

Systemtic Name: (2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-indol-3-yl)propan-1-one Openeye Name: (2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-indol-3-yl)propan-1-one CAS Name: (2R)-2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-1-(1H-indol-3-yl)-1-propanone IUPAC Name: (2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-indol-3-yl)propan-1-one Traditional Name: (2R)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1H-indol-3-yl)propan-1-one Formula: C21H23FN3O+ MolecularWeight: 352.425223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O/c1-15(21(26)19-14-23-20-5-3-2-4-18(19)20)24-10-12-25(13-11-24)17-8-6-16(22)7-9-17/h2-9,14-15,23H,10-13H2,1H3/p+1/t15-/m1/s1