N'-[1-(4-bromophenyl)carbonylpiperidin-4-yl]carbonyl-4-oxidanylidene-3H-phthalazine-1-carbohydrazide

Systemtic Name: N'-[1-(4-bromophenyl)carbonylpiperidin-4-yl]carbonyl-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[1-(4-bromobenzoyl)piperidine-4-carbonyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[[1-[(4-bromophenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[1-(4-bromobenzoyl)piperidine-4-carbonyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: N'-[1-(4-bromobenzoyl)isonipecotoyl]-4-keto-3H-phthalazine-1-carbohydrazide Formula: C22H20BrN5O4 MolecularWeight: 498.3293

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NNC(=O)C2=NNC(=O)C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCC1C(=O)NNC(=O)C2=NNC(=O)C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H20BrN5O4/c23-15-7-5-14(6-8-15)22(32)28-11-9-13(10-12-28)19(29)25-27-21(31)18-16-3-1-2-4-17(16)20(30)26-24-18/h1-8,13H,9-12H2,(H,25,29)(H,26,30)(H,27,31)