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

Systemtic Name: 2-[(2-nitro-3-phenyl-1-benzofuran-5-yl)methoxy]ethanoic acid Openeye Name: 2-[(2-nitro-3-phenyl-benzofuran-5-yl)methoxy]acetic acid CAS Name: 2-[(2-nitro-3-phenyl-5-benzofuranyl)methoxy]acetic acid IUPAC Name: 2-[(2-nitro-3-phenyl-1-benzofuran-5-yl)methoxy]acetic acid Traditional Name: 2-[(2-nitro-3-phenyl-benzofuran-5-yl)methoxy]acetic acid Formula: C17H13NO6 MolecularWeight: 327.28822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13NO6/c19-15(20)10-23-9-11-6-7-14-13(8-11)16(17(24-14)18(21)22)12-4-2-1-3-5-12/h1-8H,9-10H2,(H,19,20)