2-methyl-4-[2-oxidanylidene-2-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]phthalazin-1-one

Systemtic Name: 2-methyl-4-[2-oxidanylidene-2-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]phthalazin-1-one Openeye Name: 2-methyl-4-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)-1-piperidyl]ethyl]phthalazin-1-one CAS Name: 2-methyl-4-[2-oxo-2-[2-(1-pyrrolidinylmethyl)-1-piperidinyl]ethyl]-1-phthalazinone IUPAC Name: 2-methyl-4-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]phthalazin-1-one Traditional Name: 4-[2-keto-2-[2-(pyrrolidinomethyl)piperidino]ethyl]-2-methyl-phthalazin-1-one Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCCCC3CN4CCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCCCC3CN4CCCC4

InChI

InChI=1S/C21H28N4O2/c1-23-21(27)18-10-3-2-9-17(18)19(22-23)14-20(26)25-13-5-4-8-16(25)15-24-11-6-7-12-24/h2-3,9-10,16H,4-8,11-15H2,1H3