1,3-bis(oxidanylidene)-2-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)isoindole-5-carboxylic acid

Systemtic Name: 1,3-bis(oxidanylidene)-2-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)isoindole-5-carboxylic acid Openeye Name: 1,3-dioxo-2-(5-oxo-1-phenyl-4H-pyrazol-3-yl)isoindoline-5-carboxylic acid CAS Name: 1,3-dioxo-2-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-5-isoindolecarboxylic acid IUPAC Name: 1,3-dioxo-2-(5-oxo-1-phenyl-4H-pyrazol-3-yl)isoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-(5-keto-1-phenyl-2-pyrazolin-3-yl)isoindoline-5-carboxylic acid Formula: C18H11N3O5 MolecularWeight: 349.29704

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O

InChI

InChI=1S/C18H11N3O5/c22-15-9-14(19-21(15)11-4-2-1-3-5-11)20-16(23)12-7-6-10(18(25)26)8-13(12)17(20)24/h1-8H,9H2,(H,25,26)