N-(cyanomethyl)-1-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyl]piperidine-4-carboxamide

Systemtic Name: N-(cyanomethyl)-1-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyl]piperidine-4-carboxamide Openeye Name: N-(cyanomethyl)-1-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]piperidine-4-carboxamide CAS Name: N-(cyanomethyl)-1-[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]-4-piperidinecarboxamide IUPAC Name: N-(cyanomethyl)-1-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]piperidine-4-carboxamide Traditional Name: N-(cyanomethyl)-1-[2-(4-keto-3H-phthalazin-1-yl)acetyl]isonipecotamide Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC#N)C(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1CN(CCC1C(=O)NCC#N)C(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H19N5O3/c19-7-8-20-17(25)12-5-9-23(10-6-12)16(24)11-15-13-3-1-2-4-14(13)18(26)22-21-15/h1-4,12H,5-6,8-11H2,(H,20,25)(H,22,26)