N-(3-iodanyl-4-methyl-phenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(3-iodo-4-methylphenyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(3-iodo-4-methylphenyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C19H18IN3O2 MolecularWeight: 447.26959

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)C)I

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)C)I

InChI

InChI=1S/C19H18IN3O2/c1-3-10-23-19(25)15-7-5-4-6-14(15)17(22-23)18(24)21-13-9-8-12(2)16(20)11-13/h4-9,11H,3,10H2,1-2H3,(H,21,24)