methyl (E)-N-[2-[1-oxidanylidene-4-(phenylmethyl)phthalazin-2-yl]ethanoyl]benzenecarbohydrazonate

Systemtic Name: methyl (E)-N-[2-[1-oxidanylidene-4-(phenylmethyl)phthalazin-2-yl]ethanoyl]benzenecarbohydrazonate Openeye Name: methyl (E)-N-[2-(4-benzyl-1-oxo-phthalazin-2-yl)acetyl]benzenecarbohydrazonate CAS Name: (E)-N-[1-oxo-2-[1-oxo-4-(phenylmethyl)-2-phthalazinyl]ethyl]benzenecarbohydrazonic acid methyl ester IUPAC Name: methyl (E)-N-[2-(4-benzyl-1-oxophthalazin-2-yl)acetyl]benzenecarbohydrazonate Traditional Name: (E)-N-[2-(4-benzyl-1-keto-phthalazin-2-yl)acetyl]benzenecarbohydrazonic acid methyl ester Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NNC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CO/C(=N/NC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=CC=C3)/C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O3/c1-32-24(19-12-6-3-7-13-19)27-26-23(30)17-29-25(31)21-15-9-8-14-20(21)22(28-29)16-18-10-4-2-5-11-18/h2-15H,16-17H2,1H3,(H,26,30)/b27-24+