2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazin-1-iumyl]-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C18H24FN4O3+ MolecularWeight: 363.406563

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)C[NH+]1CCN(CC1)C(=O)CC2=CC=C(C=C2)F

Isomeric SMILES

C=CCNC(=O)NC(=O)C[NH+]1CCN(CC1)C(=O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H23FN4O3/c1-2-7-20-18(26)21-16(24)13-22-8-10-23(11-9-22)17(25)12-14-3-5-15(19)6-4-14/h2-6H,1,7-13H2,(H2,20,21,24,26)/p+1