N'-[2-[2-[(2S)-butan-2-yl]phenoxy]ethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide

Systemtic Name: N'-[2-[2-[(2S)-butan-2-yl]phenoxy]ethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[2-[2-[(1S)-1-methylpropyl]phenoxy]acetyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[2-[2-[(2S)-butan-2-yl]phenoxy]-1-oxoethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[2-[2-[(2S)-butan-2-yl]phenoxy]acetyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: 4-keto-N'-[2-[2-[(1S)-1-methylpropyl]phenoxy]acetyl]-3H-phthalazine-1-carbohydrazide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC(=O)NNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCC(=O)NNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H22N4O4/c1-3-13(2)14-8-6-7-11-17(14)29-12-18(26)22-25-21(28)19-15-9-4-5-10-16(15)20(27)24-23-19/h4-11,13H,3,12H2,1-2H3,(H,22,26)(H,24,27)(H,25,28)/t13-/m0/s1