3-(2-hydroxyethyloxycarbonyl)-5-sulfo-benzoic acid

Systemtic Name: 3-(2-hydroxyethyloxycarbonyl)-5-sulfo-benzoic acid Openeye Name: 3-(2-hydroxyethoxycarbonyl)-5-sulfo-benzoic acid CAS Name: 3-[2-hydroxyethoxy(oxo)methyl]-5-sulfobenzoic acid IUPAC Name: 3-(2-hydroxyethoxycarbonyl)-5-sulfobenzoic acid Traditional Name: 3-(2-hydroxyethoxycarbonyl)-5-sulfo-benzoic acid Formula: C10H10O8S MolecularWeight: 290.2466

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)OCCO)S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=C(C=C(C=C1C(=O)OCCO)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C10H10O8S/c11-1-2-18-10(14)7-3-6(9(12)13)4-8(5-7)19(15,16)17/h3-5,11H,1-2H2,(H,12,13)(H,15,16,17)