2-[1,3-bis(oxidanylidene)-5-sulfo-inden-2-yl]quinoline-8-sulfonic acid

Systemtic Name: 2-[1,3-bis(oxidanylidene)-5-sulfo-inden-2-yl]quinoline-8-sulfonic acid Openeye Name: 2-(1,3-dioxo-5-sulfo-indan-2-yl)quinoline-8-sulfonic acid CAS Name: 2-(1,3-dioxo-5-sulfo-2-indenyl)-8-quinolinesulfonic acid IUPAC Name: 2-(1,3-dioxo-5-sulfoinden-2-yl)quinoline-8-sulfonic acid Traditional Name: 2-(1,3-diketo-5-sulfo-indan-2-yl)quinoline-8-sulfonic acid Formula: C18H11NO8S2 MolecularWeight: 433.41184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)O)N=C(C=C2)C3C(=O)C4=C(C3=O)C=C(C=C4)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)O)N=C(C=C2)C3C(=O)C4=C(C3=O)C=C(C=C4)S(=O)(=O)O

InChI

InChI=1S/C18H11NO8S2/c20-17-11-6-5-10(28(22,23)24)8-12(11)18(21)15(17)13-7-4-9-2-1-3-14(16(9)19-13)29(25,26)27/h1-8,15H,(H,22,23,24)(H,25,26,27)