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

Systemtic Name: 1-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[2-(4-keto-3H-phthalazin-1-yl)acetyl]-N-(3-pyridylmethyl)isonipecotamide Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H23N5O3/c28-20(12-19-17-5-1-2-6-18(17)22(30)26-25-19)27-10-7-16(8-11-27)21(29)24-14-15-4-3-9-23-13-15/h1-6,9,13,16H,7-8,10-12,14H2,(H,24,29)(H,26,30)