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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=[N+](C(=O)CN2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=[N+](C(=O)CN2)CC3=CC4=C(C=C3)OCO4

InChI

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