N-(3-fluorophenyl)-2-[4-[(E)-3-quinoxalin-2-ylprop-2-enoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-[(E)-3-quinoxalin-2-ylprop-2-enoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-[(E)-3-quinoxalin-2-ylprop-2-enoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[(E)-1-oxo-3-(2-quinoxalinyl)prop-2-enyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-[(E)-3-quinoxalin-2-ylprop-2-enoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-[(E)-3-quinoxalin-2-ylacryloyl]piperazin-1-ium-1-yl]acetamide Formula: C23H23FN5O2+ MolecularWeight: 420.459423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)C=CC3=NC4=CC=CC=C4N=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)/C=C/C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C23H22FN5O2/c24-17-4-3-5-18(14-17)27-22(30)16-28-10-12-29(13-11-28)23(31)9-8-19-15-25-20-6-1-2-7-21(20)26-19/h1-9,14-15H,10-13,16H2,(H,27,30)/p+1/b9-8+