2-methyl-4-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]carbonyl-phthalazin-1-one

Systemtic Name: 2-methyl-4-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-methyl-4-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 2-methyl-4-[oxo-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]methyl]-1-phthalazinone IUPAC Name: 2-methyl-4-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 4-[4-(2-keto-2-pyrrolidino-ethyl)piperazine-1-carbonyl]-2-methyl-phthalazin-1-one Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC(=O)N4CCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C20H25N5O3/c1-22-19(27)16-7-3-2-6-15(16)18(21-22)20(28)25-12-10-23(11-13-25)14-17(26)24-8-4-5-9-24/h2-3,6-7H,4-5,8-14H2,1H3