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

Systemtic Name: 2-(2-nitro-3-phenyl-1-benzofuran-5-yl)ethanoic acid Openeye Name: 2-(2-nitro-3-phenyl-benzofuran-5-yl)acetic acid CAS Name: 2-(2-nitro-3-phenyl-5-benzofuranyl)acetic acid IUPAC Name: 2-(2-nitro-3-phenyl-1-benzofuran-5-yl)acetic acid Traditional Name: 2-(2-nitro-3-phenyl-benzofuran-5-yl)acetic acid Formula: C16H11NO5 MolecularWeight: 297.26224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11NO5/c18-14(19)9-10-6-7-13-12(8-10)15(16(22-13)17(20)21)11-4-2-1-3-5-11/h1-8H,9H2,(H,18,19)