N-(3-fluorophenyl)-2-[4-(1H-indol-3-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-(1H-indol-3-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-(1H-indole-3-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[1H-indol-3-yl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-(1H-indole-3-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-(1H-indole-3-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C21H22FN4O2+ MolecularWeight: 381.423383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H21FN4O2/c22-15-4-3-5-16(12-15)24-20(27)14-25-8-10-26(11-9-25)21(28)18-13-23-19-7-2-1-6-17(18)19/h1-7,12-13,23H,8-11,14H2,(H,24,27)/p+1