4-[2-oxidanylidene-2-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-oxidanylidene-2-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[4-[1-(4-benzyloxybutyl)imidazol-2-yl]-1-piperidyl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-oxo-2-[4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinyl]ethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-oxo-2-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]ethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-[4-[1-(4-benzoxybutyl)imidazol-2-yl]piperidino]-2-keto-ethyl]-2H-phthalazin-1-one Formula: C29H33N5O3 MolecularWeight: 499.60402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CCCCOCC3=CC=CC=C3)C(=O)CC4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CCCCOCC3=CC=CC=C3)C(=O)CC4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C29H33N5O3/c35-27(20-26-24-10-4-5-11-25(24)29(36)32-31-26)33-16-12-23(13-17-33)28-30-14-18-34(28)15-6-7-19-37-21-22-8-2-1-3-9-22/h1-5,8-11,14,18,23H,6-7,12-13,15-17,19-21H2,(H,32,36)