4-cyanobenzenesulfinate; tetrabutylazanium

Systemtic Name: 4-cyanobenzenesulfinate; tetrabutylazanium Openeye Name: 4-cyanobenzenesulfinate; tetrabutylammonium CAS Name: 4-cyanobenzenesulfinate; tetrabutylammonium IUPAC Name: 4-cyanobenzenesulfinate; tetrabutylazanium Traditional Name: 4-cyanobenzenesulfinate; tetrabutylammonium Formula: C23H40N2O2S MolecularWeight: 408.6409

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=CC=C1C#N)S(=O)[O-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=CC=C1C#N)S(=O)[O-]

InChI

InChI=1S/C16H36N.C7H5NO2S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;8-5-6-1-3-7(4-2-6)11(9)10/h5-16H2,1-4H3;1-4H,(H,9,10)/q+1;/p-1