2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(4-fluoranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(4-fluoranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)-N-(4-fluoro-3-nitro-phenyl)acetamide CAS Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)-N-(4-fluoro-3-nitrophenyl)acetamide IUPAC Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)-N-(4-fluoro-3-nitrophenyl)acetamide Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)-N-(4-fluoro-3-nitro-phenyl)acetamide Formula: C17H12FN3O5 MolecularWeight: 357.292683

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H12FN3O5/c18-13-6-5-11(8-14(13)21(25)26)19-15(22)9-20-16(23)7-10-3-1-2-4-12(10)17(20)24/h1-6,8H,7,9H2,(H,19,22)