N'-(3-methyl-4-nitro-phenyl)carbonyl-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-(3-methyl-4-nitro-phenyl)carbonyl-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide Openeye Name: N'-(3-methyl-4-nitro-benzoyl)-4-oxo-3-propyl-phthalazine-1-carbohydrazide CAS Name: N'-[(3-methyl-4-nitrophenyl)-oxomethyl]-4-oxo-3-propyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(3-methyl-4-nitrobenzoyl)-4-oxo-3-propylphthalazine-1-carbohydrazide Traditional Name: 4-keto-N'-(3-methyl-4-nitro-benzoyl)-3-propyl-phthalazine-1-carbohydrazide Formula: C20H19N5O5 MolecularWeight: 409.39536

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H19N5O5/c1-3-10-24-20(28)15-7-5-4-6-14(15)17(23-24)19(27)22-21-18(26)13-8-9-16(25(29)30)12(2)11-13/h4-9,11H,3,10H2,1-2H3,(H,21,26)(H,22,27)