ethyl 4-[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanoyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-2-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]propyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H25N5O5 MolecularWeight: 415.443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(C)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H25N5O5/c1-3-30-20(29)25-10-8-24(9-11-25)19(28)13(2)21-17(26)12-16-14-6-4-5-7-15(14)18(27)23-22-16/h4-7,13H,3,8-12H2,1-2H3,(H,21,26)(H,23,27)