N'-[(2E,4E)-hexa-2,4-dienoyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carbohydrazide

Systemtic Name: N'-[(2E,4E)-hexa-2,4-dienoyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carbohydrazide Openeye Name: 3-benzyl-N'-[(2E,4E)-hexa-2,4-dienoyl]-4-oxo-phthalazine-1-carbohydrazide CAS Name: 4-oxo-N'-[(2E,4E)-1-oxohexa-2,4-dienyl]-3-(phenylmethyl)-1-phthalazinecarbohydrazide IUPAC Name: 3-benzyl-N'-[(2E,4E)-hexa-2,4-dienoyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-benzyl-N'-[(2E,4E)-hexa-2,4-dienoyl]-4-keto-phthalazine-1-carbohydrazide Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

C/C=C/C=C/C(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C22H20N4O3/c1-2-3-5-14-19(27)23-24-21(28)20-17-12-8-9-13-18(17)22(29)26(25-20)15-16-10-6-4-7-11-16/h2-14H,15H2,1H3,(H,23,27)(H,24,28)/b3-2+,14-5+