N'-(1,3-benzodioxol-5-ylcarbonyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-(1,3-benzodioxol-5-ylcarbonyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-(1,3-benzodioxole-5-carbonyl)-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[1,3-benzodioxol-5-yl(oxo)methyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(1,3-benzodioxole-5-carbonyl)-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-4-keto-N'-piperonyloyl-phthalazine-1-carbohydrazide Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N4O5/c1-2-3-6-11-26-22(29)16-8-5-4-7-15(16)19(25-26)21(28)24-23-20(27)14-9-10-17-18(12-14)31-13-30-17/h4-5,7-10,12H,2-3,6,11,13H2,1H3,(H,23,27)(H,24,28)