1,3-bis[(1S)-2,2-dimethyl-1-(2-methylphenyl)propyl]imidazol-1-ium

Systemtic Name: 1,3-bis[(1S)-2,2-dimethyl-1-(2-methylphenyl)propyl]imidazol-1-ium Openeye Name: 1,3-bis[(1S)-2,2-dimethyl-1-(o-tolyl)propyl]imidazol-1-ium CAS Name: 1,3-bis[(1S)-2,2-dimethyl-1-(2-methylphenyl)propyl]imidazol-1-ium IUPAC Name: 1,3-bis[(1S)-2,2-dimethyl-1-(2-methylphenyl)propyl]imidazol-1-ium Traditional Name: 1,3-bis[(1S)-2,2-dimethyl-1-(o-tolyl)propyl]imidazol-1-ium Formula: C27H37N2+ MolecularWeight: 389.59608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C(C)(C)C)N2C=C[N+](=C2)C(C3=CC=CC=C3C)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1[C@H](C(C)(C)C)N2C=C[N+](=C2)[C@H](C3=CC=CC=C3C)C(C)(C)C

InChI

InChI=1S/C27H37N2/c1-20-13-9-11-15-22(20)24(26(3,4)5)28-17-18-29(19-28)25(27(6,7)8)23-16-12-10-14-21(23)2/h9-19,24-25H,1-8H3/q+1/t24-,25-/m1/s1