sodium 3-methoxycarbonylbenzenesulfonic acid

Systemtic Name: sodium 3-methoxycarbonylbenzenesulfonic acid Openeye Name: sodium 3-methoxycarbonylbenzenesulfonic acid CAS Name: sodium 3-methoxycarbonylbenzenesulfonic acid IUPAC Name: sodium 3-methoxycarbonylbenzenesulfonic acid Traditional Name: sodium 3-carbomethoxybesylic acid Formula: C8H8NaO5S+ MolecularWeight: 239.20089

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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