4-[4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-(2-methylpropanoyl)piperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-(2-methylpropanoyl)piperazine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-(4-isobutyrylpiperazine-1-carbonyl)-2H-phthalazin-1-one Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H20N4O3/c1-11(2)16(23)20-7-9-21(10-8-20)17(24)14-12-5-3-4-6-13(12)15(22)19-18-14/h3-6,11H,7-10H2,1-2H3,(H,19,22)