2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-2-phenyl-ethanoic acid Openeye Name: 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)-2-phenyl-acetic acid CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)-2-phenylacetic acid IUPAC Name: 2-(4-nitro-1,3-dioxoisoindol-2-yl)-2-phenylacetic acid Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)-2-phenyl-acetic acid Formula: C16H10N2O6 MolecularWeight: 326.2604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O6/c19-14-10-7-4-8-11(18(23)24)12(10)15(20)17(14)13(16(21)22)9-5-2-1-3-6-9/h1-8,13H,(H,21,22)