1-[(2R)-3,3-dimethylbutan-2-yl]-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium

Systemtic Name: 1-[(2R)-3,3-dimethylbutan-2-yl]-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium Openeye Name: 1-benzyl-3-[(1R)-1,2,2-trimethylpropyl]-4,5-dihydroimidazol-1-ium CAS Name: 1-[(2R)-3,3-dimethylbutan-2-yl]-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium IUPAC Name: 1-benzyl-3-[(2R)-3,3-dimethylbutan-2-yl]-4,5-dihydroimidazol-1-ium Traditional Name: 1-benzyl-3-[(1R)-1,2,2-trimethylpropyl]-2-imidazolin-1-ium Formula: C16H25N2+ MolecularWeight: 245.3831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)N1CC[N+](=C1)CC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(C)(C)C)N1CC[N+](=C1)CC2=CC=CC=C2

InChI

InChI=1S/C16H25N2/c1-14(16(2,3)4)18-11-10-17(13-18)12-15-8-6-5-7-9-15/h5-9,13-14H,10-12H2,1-4H3/q+1/t14-/m1/s1