3-ethyl-N-[(E)-(4-hexoxyphenyl)methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-ethyl-N-[(E)-(4-hexoxyphenyl)methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-ethyl-N-[(E)-(4-hexoxyphenyl)methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-ethyl-N-[(E)-(4-hexoxyphenyl)methylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-ethyl-N-[(E)-(4-hexoxyphenyl)methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-ethyl-N-[(E)-(4-hexoxybenzylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=N/NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC

InChI

InChI=1S/C24H28N4O3/c1-3-5-6-9-16-31-19-14-12-18(13-15-19)17-25-26-23(29)22-20-10-7-8-11-21(20)24(30)28(4-2)27-22/h7-8,10-15,17H,3-6,9,16H2,1-2H3,(H,26,29)/b25-17+