[(2S,3S)-3-azaniumyl-2-methyl-3-(4-methylphenyl)propyl]-diethyl-azanium

Systemtic Name: [(2S,3S)-3-azaniumyl-2-methyl-3-(4-methylphenyl)propyl]-diethyl-azanium Openeye Name: [(2S,3S)-3-azaniumyl-2-methyl-3-(p-tolyl)propyl]-diethyl-ammonium CAS Name: [(2S,3S)-3-ammonio-2-methyl-3-(4-methylphenyl)propyl]-diethylammonium IUPAC Name: [(2S,3S)-3-azaniumyl-2-methyl-3-(4-methylphenyl)propyl]-diethylazanium Traditional Name: [(2S,3S)-3-ammonio-2-methyl-3-(p-tolyl)propyl]-diethyl-ammonium Formula: C15H28N2+2 MolecularWeight: 236.39622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2/c1-5-17(6-2)11-13(4)15(16)14-9-7-12(3)8-10-14/h7-10,13,15H,5-6,11,16H2,1-4H3/p+2/t13-,15-/m0/s1