carboxylatooxymethanethioate; tetraethylazanium

Systemtic Name: carboxylatooxymethanethioate; tetraethylazanium Openeye Name: carboxylatooxymethanethioate; tetraethylammonium CAS Name: carboxylatooxymethanethioate; tetraethylammonium IUPAC Name: carboxylatooxymethanethioate; tetraethylazanium Traditional Name: carboxylatooxythioformate; tetraethylammonium Formula: C108H240N12O24S6 MolecularWeight: 2283.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/12C8H20N.6C2H2O4S/c12*1-5-9(6-2,7-3)8-4;6*3-1(4)6-2(5)7/h12*5-8H2,1-4H3;6*(H,3,4)(H,5,7)/q12*+1;;;;;;/p-12