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

Systemtic Name: [(1S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-(4-propan-2-ylphenyl)ethyl]azanium Openeye Name: [(1S)-1-(4-isopropylphenyl)-2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]ammonium CAS Name: [(1S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-(4-propan-2-ylphenyl)ethyl]ammonium IUPAC Name: [(1S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-(4-propan-2-ylphenyl)ethyl]azanium Traditional Name: [(1S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-p-cumenyl-ethyl]ammonium Formula: C15H23N3+2 MolecularWeight: 245.36322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)CC(C2=CC=C(C=C2)C(C)C)[NH3+]

Isomeric SMILES

CC1=[N+](C=CN1)C[C@H](C2=CC=C(C=C2)C(C)C)[NH3+]

InChI

InChI=1S/C15H21N3/c1-11(2)13-4-6-14(7-5-13)15(16)10-18-9-8-17-12(18)3/h4-9,11,15H,10,16H2,1-3H3/p+2/t15-/m1/s1