2-[1,3-bis(oxidanylidene)inden-2-yl]quinoline-6,8-disulfonic acid

Systemtic Name: 2-[1,3-bis(oxidanylidene)inden-2-yl]quinoline-6,8-disulfonic acid Openeye Name: 2-(1,3-dioxoindan-2-yl)quinoline-6,8-disulfonic acid CAS Name: 2-(1,3-dioxo-2-indenyl)quinoline-6,8-disulfonic acid IUPAC Name: 2-(1,3-dioxoinden-2-yl)quinoline-6,8-disulfonic acid Traditional Name: 2-(1,3-diketoindan-2-yl)quinoline-6,8-disulfonic acid Formula: C18H11NO8S2 MolecularWeight: 433.41184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C2=O)C3=NC4=C(C=C(C=C4C=C3)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(C2=O)C3=NC4=C(C=C(C=C4C=C3)S(=O)(=O)O)S(=O)(=O)O

InChI

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