2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]phthalazin-1-one

Systemtic Name: 2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]phthalazin-1-one Openeye Name: 2-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]phthalazin-1-one CAS Name: 2-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-1-phthalazinone IUPAC Name: 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]phthalazin-1-one Traditional Name: 2-[2-(4-benzylpiperidino)-2-keto-ethyl]phthalazin-1-one Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C22H23N3O2/c26-21(16-25-22(27)20-9-5-4-8-19(20)15-23-25)24-12-10-18(11-13-24)14-17-6-2-1-3-7-17/h1-9,15,18H,10-14,16H2