N-[2,6-bis(fluoranyl)phenyl]-2-isoquinolin-2-ium-2-yl-ethanamide

Systemtic Name: N-[2,6-bis(fluoranyl)phenyl]-2-isoquinolin-2-ium-2-yl-ethanamide Openeye Name: N-(2,6-difluorophenyl)-2-isoquinolin-2-ium-2-yl-acetamide CAS Name: N-(2,6-difluorophenyl)-2-(2-isoquinolin-2-iumyl)acetamide IUPAC Name: N-(2,6-difluorophenyl)-2-isoquinolin-2-ium-2-ylacetamide Traditional Name: N-(2,6-difluorophenyl)-2-isoquinolin-2-ium-2-yl-acetamide Formula: C17H13F2N2O+ MolecularWeight: 299.294726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NC3=C(C=CC=C3F)F

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NC3=C(C=CC=C3F)F

InChI

InChI=1S/C17H12F2N2O/c18-14-6-3-7-15(19)17(14)20-16(22)11-21-9-8-12-4-1-2-5-13(12)10-21/h1-10H,11H2/p+1