3-butyl-N-[(E)-(3-chloranyl-4,5-dimethoxy-phenyl)methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[(E)-(3-chloranyl-4,5-dimethoxy-phenyl)methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[(E)-(3-chloro-4,5-dimethoxy-phenyl)methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[(E)-(3-chloro-4,5-dimethoxyphenyl)methylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[(E)-(3-chloro-4,5-dimethoxyphenyl)methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-[(E)-(3-chloro-4,5-dimethoxy-benzylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C22H23ClN4O4 MolecularWeight: 442.89542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC(=C(C(=C3)Cl)OC)OC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CC(=C(C(=C3)Cl)OC)OC

InChI

InChI=1S/C22H23ClN4O4/c1-4-5-10-27-22(29)16-9-7-6-8-15(16)19(26-27)21(28)25-24-13-14-11-17(23)20(31-3)18(12-14)30-2/h6-9,11-13H,4-5,10H2,1-3H3,(H,25,28)/b24-13+