3-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(2R,6R)-2,6-dimethyl-4-morpholin-4-iumyl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,2,3-benzotriazin-4-one Formula: C14H19N4O2+ MolecularWeight: 275.32626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@@H]1C[NH+](C[C@H](O1)C)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H18N4O2/c1-10-7-17(8-11(2)20-10)9-18-14(19)12-5-3-4-6-13(12)15-16-18/h3-6,10-11H,7-9H2,1-2H3/p+1/t10-,11-/m1/s1