N-[(2-fluorophenyl)carbamoyl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(2-fluorophenyl)carbamoyl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(2-fluorophenyl)carbamoyl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(2-fluoroanilino)-oxomethyl]-2-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2-fluorophenyl)carbamoyl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(2-fluorophenyl)carbamoyl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C18H22FN5O2+2 MolecularWeight: 359.397983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC(=O)NC2=CC=CC=C2F)C3=CC=CC=[NH+]3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC(=O)NC2=CC=CC=C2F)C3=CC=CC=[NH+]3

InChI

InChI=1S/C18H20FN5O2/c19-14-5-1-2-6-15(14)21-18(26)22-17(25)13-23-9-11-24(12-10-23)16-7-3-4-8-20-16/h1-8H,9-13H2,(H2,21,22,25,26)/p+2