3-hexyl-4-oxidanylidene-N'-pyridin-3-ylcarbonyl-phthalazine-1-carbohydrazide

Systemtic Name: 3-hexyl-4-oxidanylidene-N'-pyridin-3-ylcarbonyl-phthalazine-1-carbohydrazide Openeye Name: 3-hexyl-4-oxo-N'-(pyridine-3-carbonyl)phthalazine-1-carbohydrazide CAS Name: 3-hexyl-4-oxo-N'-[oxo(3-pyridinyl)methyl]-1-phthalazinecarbohydrazide IUPAC Name: 3-hexyl-4-oxo-N'-(pyridine-3-carbonyl)phthalazine-1-carbohydrazide Traditional Name: 3-hexyl-4-keto-N'-nicotinoyl-phthalazine-1-carbohydrazide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CN=CC=C3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H23N5O3/c1-2-3-4-7-13-26-21(29)17-11-6-5-10-16(17)18(25-26)20(28)24-23-19(27)15-9-8-12-22-14-15/h5-6,8-12,14H,2-4,7,13H2,1H3,(H,23,27)(H,24,28)