5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-1,3-diium-2,4-diamine

Systemtic Name: 5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-1,3-diium-2,4-diamine Openeye Name: 5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-1,3-diium-2,4-diamine CAS Name: 5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-1,3-diium-2,4-diamine IUPAC Name: 5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-1,3-diium-2,4-diamine Traditional Name: [2-amino-5-(3,4,5-trimethoxybenzyl)pyrimidine-1,3-diium-4-yl]amine Formula: C14H20N4O3+2 MolecularWeight: 292.3336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=C[NH+]=C([NH+]=C2N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=C[NH+]=C([NH+]=C2N)N

InChI

InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)/p+2