[(1S)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-(4-propan-2-ylphenyl)ethyl]azanium

Systemtic Name: [(1S)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-(4-propan-2-ylphenyl)ethyl]azanium Openeye Name: [(1S)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)-1-(4-isopropylphenyl)ethyl]ammonium CAS Name: [(1S)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-(4-propan-2-ylphenyl)ethyl]ammonium IUPAC Name: [(1S)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-(4-propan-2-ylphenyl)ethyl]azanium Traditional Name: [(1S)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)-1-p-cumenyl-ethyl]ammonium Formula: C17H27N3+2 MolecularWeight: 273.41638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C[N+]2=C(NC=C2)C(C)C)[NH3+]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@@H](C[N+]2=C(NC=C2)C(C)C)[NH3+]

InChI

InChI=1S/C17H25N3/c1-12(2)14-5-7-15(8-6-14)16(18)11-20-10-9-19-17(20)13(3)4/h5-10,12-13,16H,11,18H2,1-4H3/p+2/t16-/m1/s1