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1-(3-nitrophenyl)ethanesulfonate; tetrabutylazanium

1-(3-nitrophenyl)ethanesulfonate; tetrabutylazanium

Systemtic Name:1-(3-nitrophenyl)ethanesulfonate; tetrabutylazanium
Openeye Name:1-(3-nitrophenyl)ethanesulfonate; tetrabutylammonium
CAS Name:1-(3-nitrophenyl)ethanesulfonate; tetrabutylammonium
IUPAC Name:1-(3-nitrophenyl)ethanesulfonate; tetrabutylazanium
Traditional Name:1-(3-nitrophenyl)ethanesulfonate; tetrabutylammonium
Formula: C24H44N2O5S
MolecularWeight: 472.68156
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H36N.C8H9NO5S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-6(15(12,13)14)7-3-2-4-8(5-7)9(10)11/h5-16H2,1-4H3;2-6H,1H3,(H,12,13,14)/q+1;/p-1


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