4-[2-(4-decylpyridin-1-ium-1-yl)ethoxycarbonyloxy]benzenesulfonic acid

Systemtic Name: 4-[2-(4-decylpyridin-1-ium-1-yl)ethoxycarbonyloxy]benzenesulfonic acid Openeye Name: 4-[2-(4-decylpyridin-1-ium-1-yl)ethoxycarbonyloxy]benzenesulfonic acid CAS Name: 4-[2-(4-decyl-1-pyridin-1-iumyl)ethoxy-oxomethoxy]benzenesulfonic acid IUPAC Name: 4-[2-(4-decylpyridin-1-ium-1-yl)ethoxycarbonyloxy]benzenesulfonic acid Traditional Name: 4-[2-(4-decylpyridin-1-ium-1-yl)ethoxycarbonyloxy]besylic acid Formula: C24H34NO6S+ MolecularWeight: 464.59486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=[N+](C=C1)CCOC(=O)OC2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCC1=CC=[N+](C=C1)CCOC(=O)OC2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C24H33NO6S/c1-2-3-4-5-6-7-8-9-10-21-15-17-25(18-16-21)19-20-30-24(26)31-22-11-13-23(14-12-22)32(27,28)29/h11-18H,2-10,19-20H2,1H3/p+1