3-ethyl-N'-(4-fluoranyl-3-nitro-phenyl)carbonyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-ethyl-N'-(4-fluoranyl-3-nitro-phenyl)carbonyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-ethyl-N'-(4-fluoro-3-nitro-benzoyl)-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-ethyl-N'-[(4-fluoro-3-nitrophenyl)-oxomethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-ethyl-N'-(4-fluoro-3-nitrobenzoyl)-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-ethyl-N'-(4-fluoro-3-nitro-benzoyl)-4-keto-phthalazine-1-carbohydrazide Formula: C18H14FN5O5 MolecularWeight: 399.332663

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H14FN5O5/c1-2-23-18(27)12-6-4-3-5-11(12)15(22-23)17(26)21-20-16(25)10-7-8-13(19)14(9-10)24(28)29/h3-9H,2H2,1H3,(H,20,25)(H,21,26)