2-methyl-4-[2-oxidanylidene-2-[(2S)-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]phthalazin-1-one

Systemtic Name: 2-methyl-4-[2-oxidanylidene-2-[(2S)-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]phthalazin-1-one Openeye Name: 2-methyl-4-[2-oxo-2-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]phthalazin-1-one CAS Name: 2-methyl-4-[2-oxo-2-[(2S)-2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]-1-phthalazinone IUPAC Name: 2-methyl-4-[2-oxo-2-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]phthalazin-1-one Traditional Name: 4-[2-keto-2-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]ethyl]-2-methyl-phthalazin-1-one Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CC(OC4=CC=CC=C43)C(=O)N5CCCCC5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3C[C@H](OC4=CC=CC=C43)C(=O)N5CCCCC5

InChI

InChI=1S/C25H26N4O4/c1-27-24(31)18-10-4-3-9-17(18)19(26-27)15-23(30)29-16-22(25(32)28-13-7-2-8-14-28)33-21-12-6-5-11-20(21)29/h3-6,9-12,22H,2,7-8,13-16H2,1H3/t22-/m0/s1