N-[4-[bis(fluoranyl)methoxy]phenyl]-2-isoquinolin-2-ium-2-yl-ethanamide chloride

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]phenyl]-2-isoquinolin-2-ium-2-yl-ethanamide chloride Openeye Name: N-[4-(difluoromethoxy)phenyl]-2-isoquinolin-2-ium-2-yl-acetamide chloride CAS Name: N-[4-(difluoromethoxy)phenyl]-2-(2-isoquinolin-2-iumyl)acetamide chloride IUPAC Name: N-[4-(difluoromethoxy)phenyl]-2-isoquinolin-2-ium-2-ylacetamide chloride Traditional Name: N-[4-(difluoromethoxy)phenyl]-2-isoquinolin-2-ium-2-yl-acetamide chloride Formula: C18H15ClF2N2O2 MolecularWeight: 364.773706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NC3=CC=C(C=C3)OC(F)F.[Cl-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NC3=CC=C(C=C3)OC(F)F.[Cl-]

InChI

InChI=1S/C18H14F2N2O2.ClH/c19-18(20)24-16-7-5-15(6-8-16)21-17(23)12-22-10-9-13-3-1-2-4-14(13)11-22;/h1-11,18H,12H2;1H