N-[(E)-1,4-diphenylbutylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-1,4-diphenylbutylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(E)-1,4-diphenylbutylideneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(E)-1,4-diphenylbutylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(E)-1,4-diphenylbutylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(E)-1,4-diphenylbutylideneamino]-4-keto-3H-phthalazine-1-carboxamide Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=NNC(=O)C2=NNC(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCC/C(=N\NC(=O)C2=NNC(=O)C3=CC=CC=C32)/C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O2/c30-24-21-16-8-7-15-20(21)23(27-28-24)25(31)29-26-22(19-13-5-2-6-14-19)17-9-12-18-10-3-1-4-11-18/h1-8,10-11,13-16H,9,12,17H2,(H,28,30)(H,29,31)/b26-22+