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

Systemtic Name: 4-[2-oxidanylidene-2-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)-1-piperidyl]ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-oxo-2-[2-(1-pyrrolidinylmethyl)-1-piperidinyl]ethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-keto-2-[2-(pyrrolidinomethyl)piperidino]ethyl]-2H-phthalazin-1-one Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CN2CCCC2)C(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCN(C(C1)CN2CCCC2)C(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H26N4O2/c25-19(13-18-16-8-1-2-9-17(16)20(26)22-21-18)24-12-4-3-7-15(24)14-23-10-5-6-11-23/h1-2,8-9,15H,3-7,10-14H2,(H,22,26)