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sodium 2-methoxycarbonylbenzenesulfonic acid

sodium 2-methoxycarbonylbenzenesulfonic acid

Systemtic Name:sodium 2-methoxycarbonylbenzenesulfonic acid
Openeye Name:sodium 2-methoxycarbonylbenzenesulfonic acid
CAS Name:sodium 2-methoxycarbonylbenzenesulfonic acid
IUPAC Name:sodium 2-methoxycarbonylbenzenesulfonic acid
Traditional Name:sodium 2-carbomethoxybesylic acid
Formula: C8H8NaO5S+
MolecularWeight: 239.20089
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)O.[Na+]


Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)O.[Na+]


InChI

InChI=1S/C8H8O5S.Na/c1-13-8(9)6-4-2-3-5-7(6)14(10,11)12;/h2-5H,1H3,(H,10,11,12);/q;+1


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