6-propoxynaphthalene-2-sulfonate; tetrabutylazanium

Systemtic Name: 6-propoxynaphthalene-2-sulfonate; tetrabutylazanium Openeye Name: 6-propoxynaphthalene-2-sulfonate; tetrabutylammonium CAS Name: 6-propoxy-2-naphthalenesulfonate; tetrabutylammonium IUPAC Name: 6-propoxynaphthalene-2-sulfonate; tetrabutylazanium Traditional Name: 6-propoxynaphthalene-2-sulfonate; tetrabutylammonium Formula: C29H49NO4S MolecularWeight: 507.76866

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CCCOC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)[O-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCCOC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)[O-]

InChI

InChI=1S/C16H36N.C13H14O4S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-2-7-17-12-5-3-11-9-13(18(14,15)16)6-4-10(11)8-12/h5-16H2,1-4H3;3-6,8-9H,2,7H2,1H3,(H,14,15,16)/q+1;/p-1