4-methyl-2-[2-[3-[methyl-(phenylmethyl)amino]piperidin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one

Systemtic Name: 4-methyl-2-[2-[3-[methyl-(phenylmethyl)amino]piperidin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one Openeye Name: 2-[2-[3-[benzyl(methyl)amino]-1-piperidyl]-2-oxo-ethyl]-4-methyl-phthalazin-1-one CAS Name: 4-methyl-2-[2-[3-[methyl-(phenylmethyl)amino]-1-piperidinyl]-2-oxoethyl]-1-phthalazinone IUPAC Name: 2-[2-[3-[benzyl(methyl)amino]piperidin-1-yl]-2-oxoethyl]-4-methylphthalazin-1-one Traditional Name: 2-[2-[3-[benzyl(methyl)amino]piperidino]-2-keto-ethyl]-4-methyl-phthalazin-1-one Formula: C24H28N4O2 MolecularWeight: 404.50472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)N3CCCC(C3)N(C)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)N3CCCC(C3)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O2/c1-18-21-12-6-7-13-22(21)24(30)28(25-18)17-23(29)27-14-8-11-20(16-27)26(2)15-19-9-4-3-5-10-19/h3-7,9-10,12-13,20H,8,11,14-17H2,1-2H3