3-[3,3-bis(3-methylphenyl)-1,2-dihydroimidazol-3-ium-2-yl]propan-1-ol

Systemtic Name: 3-[3,3-bis(3-methylphenyl)-1,2-dihydroimidazol-3-ium-2-yl]propan-1-ol Openeye Name: 3-[3,3-bis(m-tolyl)-1,2-dihydroimidazol-3-ium-2-yl]propan-1-ol CAS Name: 3-[3,3-bis(3-methylphenyl)-1,2-dihydroimidazol-3-ium-2-yl]-1-propanol IUPAC Name: 3-[3,3-bis(3-methylphenyl)-1,2-dihydroimidazol-3-ium-2-yl]propan-1-ol Traditional Name: 3-[1,1-bis(m-tolyl)-4-imidazolin-1-ium-2-yl]propan-1-ol Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)[N+]2(C=CNC2CCCO)C3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)[N+]2(C=CNC2CCCO)C3=CC=CC(=C3)C

InChI

InChI=1S/C20H25N2O/c1-16-6-3-8-18(14-16)22(19-9-4-7-17(2)15-19)12-11-21-20(22)10-5-13-23/h3-4,6-9,11-12,14-15,20-21,23H,5,10,13H2,1-2H3/q+1