4-[1-[7-(morpholin-4-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-oxidanylidene-propan-2-yl]-2H-phthalazin-1-one

Systemtic Name: 4-[1-[7-(morpholin-4-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-oxidanylidene-propan-2-yl]-2H-phthalazin-1-one Openeye Name: 4-[1-methyl-2-[7-(morpholinomethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[1-[7-(4-morpholinylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-oxopropan-2-yl]-2H-phthalazin-1-one IUPAC Name: 4-[1-[7-(morpholin-4-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-oxopropan-2-yl]-2H-phthalazin-1-one Traditional Name: 4-[2-keto-1-methyl-2-[7-(morpholinomethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-2H-phthalazin-1-one Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NNC(=O)C2=CC=CC=C21)C(=O)N3CCOC4=C(C3)C=C(C=C4)CN5CCOCC5

Isomeric SMILES

CC(C1=NNC(=O)C2=CC=CC=C21)C(=O)N3CCOC4=C(C3)C=C(C=C4)CN5CCOCC5

InChI

InChI=1S/C25H28N4O4/c1-17(23-20-4-2-3-5-21(20)24(30)27-26-23)25(31)29-10-13-33-22-7-6-18(14-19(22)16-29)15-28-8-11-32-12-9-28/h2-7,14,17H,8-13,15-16H2,1H3,(H,27,30)