N-[(Z)-(4-butoxyphenyl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-(4-butoxyphenyl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(4-butoxyphenyl)methyleneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(Z)-(4-butoxyphenyl)methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(Z)-(4-butoxyphenyl)methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(Z)-(4-butoxybenzylidene)amino]-4-keto-3H-phthalazine-1-carboxamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N\NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H20N4O3/c1-2-3-12-27-15-10-8-14(9-11-15)13-21-23-20(26)18-16-6-4-5-7-17(16)19(25)24-22-18/h4-11,13H,2-3,12H2,1H3,(H,23,26)(H,24,25)/b21-13-