(2S)-4-methyl-2-[3-(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-1-ium-1-yl]pentan-1-ol

Systemtic Name: (2S)-4-methyl-2-[3-(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-1-ium-1-yl]pentan-1-ol Openeye Name: (2S)-4-methyl-2-[3-(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-1-ium-1-yl]pentan-1-ol CAS Name: (2S)-4-methyl-2-[3-(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-1-ium-1-yl]-1-pentanol IUPAC Name: (2S)-4-methyl-2-[3-(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-1-ium-1-yl]pentan-1-ol Traditional Name: (2S)-2-(3-mesityl-2-imidazolin-1-ium-1-yl)-4-methyl-pentan-1-ol Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2CC[N+](=C2)C(CC(C)C)CO)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2CC[N+](=C2)[C@@H](CC(C)C)CO)C

InChI

InChI=1S/C18H29N2O/c1-13(2)8-17(11-21)19-6-7-20(12-19)18-15(4)9-14(3)10-16(18)5/h9-10,12-13,17,21H,6-8,11H2,1-5H3/q+1/t17-/m0/s1