4-(1,3-benzodioxol-5-yl)-N-[[4-(diethylamino)phenyl]methyl]-3-methyl-1H-imidazol-3-ium-2-amine

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-N-[[4-(diethylamino)phenyl]methyl]-3-methyl-1H-imidazol-3-ium-2-amine Openeye Name: 4-(1,3-benzodioxol-5-yl)-N-[[4-(diethylamino)phenyl]methyl]-3-methyl-1H-imidazol-3-ium-2-amine CAS Name: 4-(1,3-benzodioxol-5-yl)-N-[[4-(diethylamino)phenyl]methyl]-3-methyl-1H-imidazol-3-ium-2-amine IUPAC Name: 4-(1,3-benzodioxol-5-yl)-N-[[4-(diethylamino)phenyl]methyl]-3-methyl-1H-imidazol-3-ium-2-amine Traditional Name: [4-[[[4-(1,3-benzodioxol-5-yl)-3-methyl-1H-imidazol-3-ium-2-yl]amino]methyl]phenyl]-diethyl-amine Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CNC2=[N+](C(=CN2)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CNC2=[N+](C(=CN2)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H26N4O2/c1-4-26(5-2)18-9-6-16(7-10-18)13-23-22-24-14-19(25(22)3)17-8-11-20-21(12-17)28-15-27-20/h6-12,14H,4-5,13,15H2,1-3H3,(H,23,24)/p+1