(2R)-2-isoquinolin-2-ium-2-yl-N-[2,3,4-tris(fluoranyl)phenyl]propanamide

Systemtic Name: (2R)-2-isoquinolin-2-ium-2-yl-N-[2,3,4-tris(fluoranyl)phenyl]propanamide Openeye Name: (2R)-2-isoquinolin-2-ium-2-yl-N-(2,3,4-trifluorophenyl)propanamide CAS Name: (2R)-2-(2-isoquinolin-2-iumyl)-N-(2,3,4-trifluorophenyl)propanamide IUPAC Name: (2R)-2-isoquinolin-2-ium-2-yl-N-(2,3,4-trifluorophenyl)propanamide Traditional Name: (2R)-2-isoquinolin-2-ium-2-yl-N-(2,3,4-trifluorophenyl)propionamide Formula: C18H14F3N2O+ MolecularWeight: 331.31177

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C(=C(C=C1)F)F)F)[N+]2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C[C@H](C(=O)NC1=C(C(=C(C=C1)F)F)F)[N+]2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H13F3N2O/c1-11(23-9-8-12-4-2-3-5-13(12)10-23)18(24)22-15-7-6-14(19)16(20)17(15)21/h2-11H,1H3/p+1/t11-/m1/s1