3-(1,3-benzodioxol-5-ylmethyl)-2-[(2,4-dimethylphenyl)amino]-1,5-dihydroimidazol-3-ium-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-[(2,4-dimethylphenyl)amino]-1,5-dihydroimidazol-3-ium-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(2,4-dimethylanilino)-1,5-dihydroimidazol-3-ium-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(2,4-dimethylanilino)-1,5-dihydroimidazol-3-ium-4-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(2,4-dimethylanilino)-1,5-dihydroimidazol-3-ium-4-one Traditional Name: 2-(2,4-dimethylanilino)-3-piperonyl-2-imidazolin-3-ium-4-one Formula: C19H20N3O3+ MolecularWeight: 338.3804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=[N+](C(=O)CN2)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=[N+](C(=O)CN2)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C19H19N3O3/c1-12-3-5-15(13(2)7-12)21-19-20-9-18(23)22(19)10-14-4-6-16-17(8-14)25-11-24-16/h3-8H,9-11H2,1-2H3,(H,20,21)/p+1