2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine

Systemtic Name: 2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine Openeye Name: 2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine CAS Name: 2-[4-[(1-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-3-pyridin-1-iumamine IUPAC Name: 2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine Traditional Name: [2-[4-[(1-methylpyrazol-4-yl)methyl]piperazino]pyridin-1-ium-3-yl]amine Formula: C14H21N6+ MolecularWeight: 273.35674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CCN(CC2)C3=C(C=CC=[NH+]3)N

Isomeric SMILES

CN1C=C(C=N1)CN2CCN(CC2)C3=C(C=CC=[NH+]3)N

InChI

InChI=1S/C14H20N6/c1-18-10-12(9-17-18)11-19-5-7-20(8-6-19)14-13(15)3-2-4-16-14/h2-4,9-10H,5-8,11,15H2,1H3/p+1