[(1S)-3-azaniumyl-1-(4-propan-2-ylphenyl)propyl]-dimethyl-azanium

Systemtic Name: [(1S)-3-azaniumyl-1-(4-propan-2-ylphenyl)propyl]-dimethyl-azanium Openeye Name: [(1S)-3-azaniumyl-1-(4-isopropylphenyl)propyl]-dimethyl-ammonium CAS Name: [(1S)-3-ammonio-1-(4-propan-2-ylphenyl)propyl]-dimethylammonium IUPAC Name: [(1S)-3-azaniumyl-1-(4-propan-2-ylphenyl)propyl]-dimethylazanium Traditional Name: [(1S)-3-ammonio-1-p-cumenyl-propyl]-dimethyl-ammonium Formula: C14H26N2+2 MolecularWeight: 222.36964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(CC[NH3+])[NH+](C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@H](CC[NH3+])[NH+](C)C

InChI

InChI=1S/C14H24N2/c1-11(2)12-5-7-13(8-6-12)14(9-10-15)16(3)4/h5-8,11,14H,9-10,15H2,1-4H3/p+2/t14-/m0/s1