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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

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