1-oxidanidyl-2-pyridin-2-yl-indol-1-ium-3-one; sulfuric acid

Systemtic Name: 1-oxidanidyl-2-pyridin-2-yl-indol-1-ium-3-one; sulfuric acid Openeye Name: 1-oxido-2-(2-pyridyl)indol-1-ium-3-one; sulfuric acid CAS Name: 1-oxido-2-(2-pyridinyl)-3-indol-1-iumone; sulfuric acid IUPAC Name: 1-oxido-2-pyridin-2-ylindol-1-ium-3-one; sulfuric acid Traditional Name: 1-oxido-2-(2-pyridyl)indol-1-ium-3-one; sulfuric acid Formula: C26H18N4O8S MolecularWeight: 546.50812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=[N+]2[O-])C3=CC=CC=N3.C1=CC=C2C(=C1)C(=O)C(=[N+]2[O-])C3=CC=CC=N3.OS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=[N+]2[O-])C3=CC=CC=N3.C1=CC=C2C(=C1)C(=O)C(=[N+]2[O-])C3=CC=CC=N3.OS(=O)(=O)O

InChI

InChI=1S/2C13H8N2O2.H2O4S/c2*16-13-9-5-1-2-7-11(9)15(17)12(13)10-6-3-4-8-14-10;1-5(2,3)4/h2*1-8H;(H2,1,2,3,4)