5-[(3-hexyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[(3-hexyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[(3-hexyl-4-oxo-phthalazine-1-carbonyl)amino]benzene-1,3-dicarboxamide CAS Name: 5-[[(3-hexyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[(3-hexyl-4-oxophthalazine-1-carbonyl)amino]benzene-1,3-dicarboxamide Traditional Name: 5-[(3-hexyl-4-keto-phthalazine-1-carbonyl)amino]isophthalamide Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC(=C3)C(=O)N)C(=O)N

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC(=C3)C(=O)N)C(=O)N

InChI

InChI=1S/C23H25N5O4/c1-2-3-4-7-10-28-23(32)18-9-6-5-8-17(18)19(27-28)22(31)26-16-12-14(20(24)29)11-15(13-16)21(25)30/h5-6,8-9,11-13H,2-4,7,10H2,1H3,(H2,24,29)(H2,25,30)(H,26,31)