(4-pyridin-1-ium-2-ylpiperazin-1-yl)-pyridin-4-yl-methanone

Systemtic Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-pyridin-4-yl-methanone Openeye Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(4-pyridyl)methanone CAS Name: [4-(2-pyridin-1-iumyl)-1-piperazinyl]-pyridin-4-ylmethanone IUPAC Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-pyridin-4-ylmethanone Traditional Name: (4-pyridin-1-ium-2-ylpiperazino)-(4-pyridyl)methanone Formula: C15H17N4O+ MolecularWeight: 269.32168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=NC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C15H16N4O/c20-15(13-4-7-16-8-5-13)19-11-9-18(10-12-19)14-3-1-2-6-17-14/h1-8H,9-12H2/p+1