1-(2,3-dihydroindol-1-yl)-3-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]propan-1-one

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-3-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]propan-1-one Openeye Name: 3-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]-1-indolin-1-yl-propan-1-one CAS Name: 3-[4-(4-acetyl-2-fluorophenyl)-1-piperazin-1-iumyl]-1-(2,3-dihydroindol-1-yl)-1-propanone IUPAC Name: 3-[4-(4-acetyl-2-fluorophenyl)piperazin-1-ium-1-yl]-1-(2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 3-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]-1-indolin-1-yl-propan-1-one Formula: C23H27FN3O2+ MolecularWeight: 396.477783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CCC(=O)N3CCC4=CC=CC=C43)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CCC(=O)N3CCC4=CC=CC=C43)F

InChI

InChI=1S/C23H26FN3O2/c1-17(28)19-6-7-22(20(24)16-19)26-14-12-25(13-15-26)10-9-23(29)27-11-8-18-4-2-3-5-21(18)27/h2-7,16H,8-15H2,1H3/p+1