2-methyl-4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one

Systemtic Name: 2-methyl-4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one Openeye Name: 2-methyl-4-[2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]phthalazin-1-one CAS Name: 2-methyl-4-[2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethyl]-1-phthalazinone IUPAC Name: 2-methyl-4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]phthalazin-1-one Traditional Name: 4-[2-keto-2-[(2S)-2-methylpiperidino]ethyl]-2-methyl-phthalazin-1-one Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

C[C@H]1CCCCN1C(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C17H21N3O2/c1-12-7-5-6-10-20(12)16(21)11-15-13-8-3-4-9-14(13)17(22)19(2)18-15/h3-4,8-9,12H,5-7,10-11H2,1-2H3/t12-/m0/s1