2-(furan-2-yl)-6-sulfo-quinoline-3,4-dicarboxylic acid

Systemtic Name: 2-(furan-2-yl)-6-sulfo-quinoline-3,4-dicarboxylic acid Openeye Name: 2-(2-furyl)-6-sulfo-quinoline-3,4-dicarboxylic acid CAS Name: 2-(2-furanyl)-6-sulfoquinoline-3,4-dicarboxylic acid IUPAC Name: 2-(furan-2-yl)-6-sulfoquinoline-3,4-dicarboxylic acid Traditional Name: 2-(2-furyl)-6-sulfo-quinoline-3,4-dicarboxylic acid Formula: C15H9NO8S MolecularWeight: 363.29886

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C(C(=C3C=C(C=CC3=N2)S(=O)(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=COC(=C1)C2=C(C(=C3C=C(C=CC3=N2)S(=O)(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C15H9NO8S/c17-14(18)11-8-6-7(25(21,22)23)3-4-9(8)16-13(12(11)15(19)20)10-2-1-5-24-10/h1-6H,(H,17,18)(H,19,20)(H,21,22,23)