2-(2-nitro-3-phenyl-1-benzofuran-5-yl)-2-oxidanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-(2-nitro-3-phenyl-1-benzofuran-5-yl)-2-oxidanyl-2-phenyl-ethanoic acid Openeye Name: 2-hydroxy-2-(2-nitro-3-phenyl-benzofuran-5-yl)-2-phenyl-acetic acid CAS Name: 2-hydroxy-2-(2-nitro-3-phenyl-5-benzofuranyl)-2-phenylacetic acid IUPAC Name: 2-hydroxy-2-(2-nitro-3-phenyl-1-benzofuran-5-yl)-2-phenylacetic acid Traditional Name: 2-hydroxy-2-(2-nitro-3-phenyl-benzofuran-5-yl)-2-phenyl-acetic acid Formula: C22H15NO6 MolecularWeight: 389.3576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC3=C2C=C(C=C3)C(C4=CC=CC=C4)(C(=O)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC3=C2C=C(C=C3)C(C4=CC=CC=C4)(C(=O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H15NO6/c24-21(25)22(26,15-9-5-2-6-10-15)16-11-12-18-17(13-16)19(20(29-18)23(27)28)14-7-3-1-4-8-14/h1-13,26H,(H,24,25)