3-(phenylsulfonyl)benzenesulfonate; tetraethylazanium

Systemtic Name: 3-(phenylsulfonyl)benzenesulfonate; tetraethylazanium Openeye Name: 3-(benzenesulfonyl)benzenesulfonate; tetraethylammonium CAS Name: 3-(benzenesulfonyl)benzenesulfonate; tetraethylammonium IUPAC Name: 3-(benzenesulfonyl)benzenesulfonate; tetraethylazanium Traditional Name: 3-besylbesylate; tetraethylammonium Formula: C20H29NO5S2 MolecularWeight: 427.57796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10O5S2.C8H20N/c13-18(14,10-5-2-1-3-6-10)11-7-4-8-12(9-11)19(15,16)17;1-5-9(6-2,7-3)8-4/h1-9H,(H,15,16,17);5-8H2,1-4H3/q;+1/p-1