N'-[4-(3-methylphenoxy)butanoyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[4-(3-methylphenoxy)butanoyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-[4-(3-methylphenoxy)butanoyl]-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[4-(3-methylphenoxy)-1-oxobutyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-[4-(3-methylphenoxy)butanoyl]-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-4-keto-N'-[4-(3-methylphenoxy)butanoyl]phthalazine-1-carbohydrazide Formula: C25H30N4O4 MolecularWeight: 450.5301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCCOC3=CC=CC(=C3)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCCOC3=CC=CC(=C3)C

InChI

InChI=1S/C25H30N4O4/c1-3-4-7-15-29-25(32)21-13-6-5-12-20(21)23(28-29)24(31)27-26-22(30)14-9-16-33-19-11-8-10-18(2)17-19/h5-6,8,10-13,17H,3-4,7,9,14-16H2,1-2H3,(H,26,30)(H,27,31)