6-[(4-phenylmethoxypiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(4-phenylmethoxypiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-benzyloxypiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[(4-phenylmethoxy-1-piperidin-1-iumyl)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4-phenylmethoxypiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(4-benzoxypiperidin-1-ium-1-yl)methyl]-s-triazin-2-yl]amine Formula: C16H23N6O+ MolecularWeight: 315.39342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OCC2=CC=CC=C2)CC3=NC(=NC(=N3)N)N

Isomeric SMILES

C1C[NH+](CCC1OCC2=CC=CC=C2)CC3=NC(=NC(=N3)N)N

InChI

InChI=1S/C16H22N6O/c17-15-19-14(20-16(18)21-15)10-22-8-6-13(7-9-22)23-11-12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H4,17,18,19,20,21)/p+1