2-[4-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]piperazin-1-ium-1-yl]-N-pyridin-2-yl-ethanamide

Systemtic Name: 2-[4-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]piperazin-1-ium-1-yl]-N-pyridin-2-yl-ethanamide Openeye Name: 2-[4-[2-oxo-2-(2-pyridylamino)ethyl]piperazin-1-ium-1-yl]-N-(2-pyridyl)acetamide CAS Name: 2-[4-[2-oxo-2-(2-pyridinylamino)ethyl]-1-piperazin-1-iumyl]-N-(2-pyridinyl)acetamide IUPAC Name: 2-[4-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperazin-1-ium-1-yl]-N-pyridin-2-ylacetamide Traditional Name: 2-[4-[2-keto-2-(2-pyridylamino)ethyl]piperazin-1-ium-1-yl]-N-(2-pyridyl)acetamide Formula: C18H23N6O2+ MolecularWeight: 355.41422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=N2)CC(=O)NC3=CC=CC=N3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=N2)CC(=O)NC3=CC=CC=N3

InChI

InChI=1S/C18H22N6O2/c25-17(21-15-5-1-3-7-19-15)13-23-9-11-24(12-10-23)14-18(26)22-16-6-2-4-8-20-16/h1-8H,9-14H2,(H,19,21,25)(H,20,22,26)/p+1