4,5-bis(oxidanylidene)-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid

Systemtic Name: 4,5-bis(oxidanylidene)-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid Openeye Name: 4,5-dioxo-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid CAS Name: 4,5-dioxo-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid IUPAC Name: 4,5-dioxo-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid Traditional Name: 4,5-diketo-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid Formula: C14H6N2O8 MolecularWeight: 358.101628

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(C(=O)C(=O)C3=C2NC(=C3)C(=O)O)N=C1C(=O)O)C(=O)O

Isomeric SMILES

[14CH]1=[14C]([14C]2=[14C]([14C](=O)[14C](=O)[14C]3=[14C]2N[14C](=[14CH]3)[14C](=O)O)N=[14C]1[14C](=O)O)[14C](=O)O

InChI

InChI=1S/C14H6N2O8/c17-10-4-2-6(14(23)24)15-8(4)7-3(12(19)20)1-5(13(21)22)16-9(7)11(10)18/h1-2,15H,(H,19,20)(H,21,22)(H,23,24)/i1+2,2+2,3+2,4+2,5+2,6+2,7+2,8+2,9+2,10+2,11+2,12+2,13+2,14+2