2-nitro-2-[(3-phenyl-1-benzofuran-6-yl)oxy]ethanoic acid

Systemtic Name: 2-nitro-2-[(3-phenyl-1-benzofuran-6-yl)oxy]ethanoic acid Openeye Name: 2-nitro-2-(3-phenylbenzofuran-6-yl)oxy-acetic acid CAS Name: 2-nitro-2-[(3-phenyl-6-benzofuranyl)oxy]acetic acid IUPAC Name: 2-nitro-2-[(3-phenyl-1-benzofuran-6-yl)oxy]acetic acid Traditional Name: 2-nitro-2-(3-phenylbenzofuran-6-yl)oxy-acetic acid Formula: C16H11NO6 MolecularWeight: 313.26164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=COC3=C2C=CC(=C3)OC(C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=COC3=C2C=CC(=C3)OC(C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO6/c18-16(19)15(17(20)21)23-11-6-7-12-13(9-22-14(12)8-11)10-4-2-1-3-5-10/h1-9,15H,(H,18,19)