N-(3-chloranyl-4-methoxy-phenyl)-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-hexyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-hexyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-hexyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-hexyl-4-keto-phthalazine-1-carboxamide Formula: C22H24ClN3O3 MolecularWeight: 413.89726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClN3O3/c1-3-4-5-8-13-26-22(28)17-10-7-6-9-16(17)20(25-26)21(27)24-15-11-12-19(29-2)18(23)14-15/h6-7,9-12,14H,3-5,8,13H2,1-2H3,(H,24,27)