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

Systemtic Name: ethyl 1-[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]propyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]propanoyl]isonipecotic acid ethyl ester Formula: C21H26N4O5 MolecularWeight: 414.45494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(C)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H26N4O5/c1-3-30-21(29)14-8-10-25(11-9-14)20(28)13(2)22-18(26)12-17-15-6-4-5-7-16(15)19(27)24-23-17/h4-7,13-14H,3,8-12H2,1-2H3,(H,22,26)(H,24,27)