2-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]phthalazin-1-one

Systemtic Name: 2-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]phthalazin-1-one Openeye Name: 2-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl]phthalazin-1-one CAS Name: 2-[2-(4-acetyl-1-piperazinyl)-2-oxoethyl]-1-phthalazinone IUPAC Name: 2-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]phthalazin-1-one Traditional Name: 2-[2-(4-acetylpiperazino)-2-keto-ethyl]phthalazin-1-one Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C=N2

InChI

InChI=1S/C16H18N4O3/c1-12(21)18-6-8-19(9-7-18)15(22)11-20-16(23)14-5-3-2-4-13(14)10-17-20/h2-5,10H,6-9,11H2,1H3