4-[1-cyano-2-[2-[(3-nitrophenyl)methoxy]phenyl]ethenyl]benzoic acid

Systemtic Name: 4-[1-cyano-2-[2-[(3-nitrophenyl)methoxy]phenyl]ethenyl]benzoic acid Openeye Name: 4-[1-cyano-2-[2-[(3-nitrophenyl)methoxy]phenyl]vinyl]benzoic acid CAS Name: 4-[1-cyano-2-[2-[(3-nitrophenyl)methoxy]phenyl]ethenyl]benzoic acid IUPAC Name: 4-[1-cyano-2-[2-[(3-nitrophenyl)methoxy]phenyl]ethenyl]benzoic acid Traditional Name: 4-[1-cyano-2-[2-(3-nitrobenzyl)oxyphenyl]vinyl]benzoic acid Formula: C23H16N2O5 MolecularWeight: 400.38354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)OCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)OCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

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