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

Systemtic Name: [(2S,3S)-3-azaniumyl-3-(4-ethylphenyl)-2-methyl-propyl]-diethyl-azanium Openeye Name: [(2S,3S)-3-azaniumyl-3-(4-ethylphenyl)-2-methyl-propyl]-diethyl-ammonium CAS Name: [(2S,3S)-3-ammonio-3-(4-ethylphenyl)-2-methylpropyl]-diethylammonium IUPAC Name: [(2S,3S)-3-azaniumyl-3-(4-ethylphenyl)-2-methylpropyl]-diethylazanium Traditional Name: [(2S,3S)-3-ammonio-3-(4-ethylphenyl)-2-methyl-propyl]-diethyl-ammonium Formula: C16H30N2+2 MolecularWeight: 250.4228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C[NH+](CC)CC)[NH3+]

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]([C@@H](C)C[NH+](CC)CC)[NH3+]

InChI

InChI=1S/C16H28N2/c1-5-14-8-10-15(11-9-14)16(17)13(4)12-18(6-2)7-3/h8-11,13,16H,5-7,12,17H2,1-4H3/p+2/t13-,16-/m0/s1