sodium 4-[(E)-2-(5-nitrofuran-2-yl)ethenyl]benzoate

Systemtic Name: sodium 4-[(E)-2-(5-nitrofuran-2-yl)ethenyl]benzoate Openeye Name: sodium 4-[(E)-2-(5-nitro-2-furyl)vinyl]benzoate CAS Name: sodium 4-[(E)-2-(5-nitro-2-furanyl)ethenyl]benzoate IUPAC Name: sodium 4-[(E)-2-(5-nitrofuran-2-yl)ethenyl]benzoate Traditional Name: sodium 4-[(E)-2-(5-nitro-2-furyl)vinyl]benzoate Formula: C13H8NNaO5 MolecularWeight: 281.19609

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=CC=C(O2)[N+](=O)[O-])C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=CC=C(O2)[N+](=O)[O-])C(=O)[O-].[Na+]

InChI

InChI=1S/C13H9NO5.Na/c15-13(16)10-4-1-9(2-5-10)3-6-11-7-8-12(19-11)14(17)18;/h1-8H,(H,15,16);/q;+1/p-1/b6-3+;