5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]-2H-1,2,4-triazin-3-one

Systemtic Name: 5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]-2H-1,2,4-triazin-3-one Openeye Name: 5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]-2H-1,2,4-triazin-3-one CAS Name: 5-[(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)amino]-2H-1,2,4-triazin-3-one IUPAC Name: 5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]-2H-1,2,4-triazin-3-one Traditional Name: 5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]-2H-1,2,4-triazin-3-one Formula: C12H22N5O+ MolecularWeight: 252.33598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC2=NC(=O)NN=C2)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC2=NC(=O)NN=C2)C

InChI

InChI=1S/C12H21N5O/c1-11(2)5-8(6-12(3,4)17-11)14-9-7-13-16-10(18)15-9/h7-8,17H,5-6H2,1-4H3,(H2,14,15,16,18)/p+1