N'-[(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)carbonyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)carbonyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-(5-chloro-2,3-dihydrobenzofuran-2-carbonyl)-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[(5-chloro-2,3-dihydrobenzofuran-2-yl)-oxomethyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(5-chloro-2,3-dihydro-1-benzofuran-2-carbonyl)-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-N'-(5-chlorocoumaran-2-carbonyl)-4-keto-phthalazine-1-carbohydrazide Formula: C23H23ClN4O4 MolecularWeight: 454.90612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C23H23ClN4O4/c1-2-3-6-11-28-23(31)17-8-5-4-7-16(17)20(27-28)22(30)26-25-21(29)19-13-14-12-15(24)9-10-18(14)32-19/h4-5,7-10,12,19H,2-3,6,11,13H2,1H3,(H,25,29)(H,26,30)