3-butyl-N'-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-butyl-N'-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-butyl-N'-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-butyl-N'-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-butyl-N'-[[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-butyl-4-keto-N'-[(3-keto-2-methyl-5-methylol-4-pyridylidene)methyl]phthalazine-1-carbohydrazide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC=C3C(=CN=C(C3=O)C)CO

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC=C3C(=CN=C(C3=O)C)CO

InChI

InChI=1S/C21H23N5O4/c1-3-4-9-26-21(30)16-8-6-5-7-15(16)18(25-26)20(29)24-23-11-17-14(12-27)10-22-13(2)19(17)28/h5-8,10-11,23,27H,3-4,9,12H2,1-2H3,(H,24,29)