methylbenzene; tetrapropylazanium; sulfate

Systemtic Name: methylbenzene; tetrapropylazanium; sulfate Openeye Name: tetrapropylammonium; toluene; sulfate CAS Name: tetrapropylammonium; toluene; sulfate IUPAC Name: tetrapropylazanium; toluene; sulfate Traditional Name: tetrapropylammonium; toluene; sulfate Formula: C31H64N2O4S MolecularWeight: 560.91586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](CCC)(CCC)CCC.CCC[N+](CCC)(CCC)CCC.CC1=CC=CC=C1.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCC[N+](CCC)(CCC)CCC.CCC[N+](CCC)(CCC)CCC.CC1=CC=CC=C1.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C12H28N.C7H8.H2O4S/c2*1-5-9-13(10-6-2,11-7-3)12-8-4;1-7-5-3-2-4-6-7;1-5(2,3)4/h2*5-12H2,1-4H3;2-6H,1H3;(H2,1,2,3,4)/q2*+1;;/p-2