3-(2-ethoxy-2,2-diphenyl-ethanoyl)oxypropyl-diethyl-methyl-azanium; methyl sulfate

Systemtic Name: 3-(2-ethoxy-2,2-diphenyl-ethanoyl)oxypropyl-diethyl-methyl-azanium; methyl sulfate Openeye Name: 3-(2-ethoxy-2,2-diphenyl-acetyl)oxypropyl-diethyl-methyl-ammonium; methyl sulfate CAS Name: 3-(2-ethoxy-1-oxo-2,2-diphenylethoxy)propyl-diethyl-methylammonium; methyl sulfate IUPAC Name: 3-(2-ethoxy-2,2-diphenylacetyl)oxypropyl-diethyl-methylazanium; methyl sulfate Traditional Name: 3-(2-ethoxy-2,2-diphenyl-acetyl)oxypropyl-diethyl-methyl-ammonium; methyl sulfate Formula: C25H37NO7S MolecularWeight: 495.62878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC.COS(=O)(=O)[O-]

Isomeric SMILES

CC[N+](C)(CC)CCCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC.COS(=O)(=O)[O-]

InChI

InChI=1S/C24H34NO3.CH4O4S/c1-5-25(4,6-2)19-14-20-27-23(26)24(28-7-3,21-15-10-8-11-16-21)22-17-12-9-13-18-22;1-5-6(2,3)4/h8-13,15-18H,5-7,14,19-20H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1