4-[5-[(E)-2-nitroethenyl]furan-2-yl]benzoate

Systemtic Name: 4-[5-[(E)-2-nitroethenyl]furan-2-yl]benzoate Openeye Name: 4-[5-[(E)-2-nitrovinyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-2-nitroethenyl]-2-furanyl]benzoate IUPAC Name: 4-[5-[(E)-2-nitroethenyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-2-nitrovinyl]-2-furyl]benzoate Formula: C13H8NO5- MolecularWeight: 258.20632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)C=C[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)/C=C/[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H9NO5/c15-13(16)10-3-1-9(2-4-10)12-6-5-11(19-12)7-8-14(17)18/h1-8H,(H,15,16)/p-1/b8-7+