(2-chloranylpyridin-3-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-chloranylpyridin-3-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (2-chloro-3-pyridyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: (2-chloro-3-pyridinyl)-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (2-chloropyridin-3-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (2-chloro-3-pyridyl)-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C15H16ClN4O+ MolecularWeight: 303.76674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15ClN4O/c16-14-12(4-3-7-18-14)15(21)20-10-8-19(9-11-20)13-5-1-2-6-17-13/h1-7H,8-11H2/p+1