6-(4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-methoxy-3-phenylmethoxy-aniline

Systemtic Name: 6-(4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-methoxy-3-phenylmethoxy-aniline Openeye Name: 3-benzyloxy-6-(4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-methoxy-aniline CAS Name: 6-(4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-methoxy-3-phenylmethoxyaniline IUPAC Name: 6-(4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-methoxy-3-phenylmethoxyaniline Traditional Name: [3-benzoxy-6-(2-imidazolin-1-ium-2-yl)-2-methoxy-phenyl]amine Formula: C17H20N3O2+ MolecularWeight: 298.3596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1N)C2=[NH+]CCN2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1N)C2=[NH+]CCN2)OCC3=CC=CC=C3

InChI

InChI=1S/C17H19N3O2/c1-21-16-14(22-11-12-5-3-2-4-6-12)8-7-13(15(16)18)17-19-9-10-20-17/h2-8H,9-11,18H2,1H3,(H,19,20)/p+1