2,4-dimethyl-6-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]-1,2,4-triazine-3,5-dione

Systemtic Name: 2,4-dimethyl-6-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]-1,2,4-triazine-3,5-dione Openeye Name: 6-[(1-benzylpiperidin-1-ium-4-yl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione CAS Name: 2,4-dimethyl-6-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]-1,2,4-triazine-3,5-dione IUPAC Name: 6-[(1-benzylpiperidin-1-ium-4-yl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione Traditional Name: 6-[(1-benzylpiperidin-1-ium-4-yl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-quinone Formula: C17H24N5O2+ MolecularWeight: 330.40476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=NN(C1=O)C)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=NN(C1=O)C)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H23N5O2/c1-20-16(23)15(19-21(2)17(20)24)18-14-8-10-22(11-9-14)12-13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3,(H,18,19)/p+1