2-[4-(2-nitro-3-phenyl-1-benzofuran-5-yl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(2-nitro-3-phenyl-1-benzofuran-5-yl)phenyl]ethanoic acid Openeye Name: 2-[4-(2-nitro-3-phenyl-benzofuran-5-yl)phenyl]acetic acid CAS Name: 2-[4-(2-nitro-3-phenyl-5-benzofuranyl)phenyl]acetic acid IUPAC Name: 2-[4-(2-nitro-3-phenyl-1-benzofuran-5-yl)phenyl]acetic acid Traditional Name: 2-[4-(2-nitro-3-phenyl-benzofuran-5-yl)phenyl]acetic acid Formula: C22H15NO5 MolecularWeight: 373.3582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H15NO5/c24-20(25)12-14-6-8-15(9-7-14)17-10-11-19-18(13-17)21(22(28-19)23(26)27)16-4-2-1-3-5-16/h1-11,13H,12H2,(H,24,25)