4,4-diphenylbutan-2-yl-ethyl-dimethyl-azanium sulfate

Systemtic Name: 4,4-diphenylbutan-2-yl-ethyl-dimethyl-azanium sulfate Openeye Name: ethyl-dimethyl-(1-methyl-3,3-diphenyl-propyl)ammonium sulfate CAS Name: 4,4-diphenylbutan-2-yl-ethyl-dimethylammonium sulfate IUPAC Name: 4,4-diphenylbutan-2-yl-ethyl-dimethylazanium sulfate Traditional Name: ethyl-dimethyl-(1-methyl-3,3-diphenyl-propyl)ammonium sulfate Formula: C20H28NO4S- MolecularWeight: 378.50562

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)C(C)CC(C1=CC=CC=C1)C2=CC=CC=C2.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC[N+](C)(C)C(C)CC(C1=CC=CC=C1)C2=CC=CC=C2.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C20H28N.H2O4S/c1-5-21(3,4)17(2)16-20(18-12-8-6-9-13-18)19-14-10-7-11-15-19;1-5(2,3)4/h6-15,17,20H,5,16H2,1-4H3;(H2,1,2,3,4)/q+1;/p-2