N-(4-fluorophenyl)-2-(2-isoquinolin-2-ium-2-ylethanoylamino)ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-(2-isoquinolin-2-ium-2-ylethanoylamino)ethanamide Openeye Name: N-(4-fluorophenyl)-2-[(2-isoquinolin-2-ium-2-ylacetyl)amino]acetamide CAS Name: N-(4-fluorophenyl)-2-[[2-(2-isoquinolin-2-iumyl)-1-oxoethyl]amino]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[(2-isoquinolin-2-ium-2-ylacetyl)amino]acetamide Traditional Name: N-(4-fluorophenyl)-2-[(2-isoquinolin-2-ium-2-ylacetyl)amino]acetamide Formula: C19H17FN3O2+ MolecularWeight: 338.355583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C19H16FN3O2/c20-16-5-7-17(8-6-16)22-18(24)11-21-19(25)13-23-10-9-14-3-1-2-4-15(14)12-23/h1-10,12H,11,13H2,(H-,21,22,24,25)/p+1