3-[[4-[(E)-2-cyano-2-(3-nitrophenyl)ethenyl]phenoxy]methyl]benzoate

Systemtic Name: 3-[[4-[(E)-2-cyano-2-(3-nitrophenyl)ethenyl]phenoxy]methyl]benzoate Openeye Name: 3-[[4-[(E)-2-cyano-2-(3-nitrophenyl)vinyl]phenoxy]methyl]benzoate CAS Name: 3-[[4-[(E)-2-cyano-2-(3-nitrophenyl)ethenyl]phenoxy]methyl]benzoate IUPAC Name: 3-[[4-[(E)-2-cyano-2-(3-nitrophenyl)ethenyl]phenoxy]methyl]benzoate Traditional Name: 3-[[4-[(E)-2-cyano-2-(3-nitrophenyl)vinyl]phenoxy]methyl]benzoate Formula: C23H15N2O5- MolecularWeight: 399.3756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC2=CC=C(C=C2)C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)COC2=CC=C(C=C2)/C=C(/C#N)\C3=CC(=CC=C3)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C23H16N2O5/c24-14-20(18-4-2-6-21(13-18)25(28)29)11-16-7-9-22(10-8-16)30-15-17-3-1-5-19(12-17)23(26)27/h1-13H,15H2,(H,26,27)/p-1/b20-11-