4-[[2-(2-nitroethenyl)phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-(2-nitroethenyl)phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-(2-nitrovinyl)phenoxy]methyl]benzoic acid CAS Name: 4-[[2-(2-nitroethenyl)phenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-(2-nitroethenyl)phenoxy]methyl]benzoic acid Traditional Name: 4-[[2-(2-nitrovinyl)phenoxy]methyl]benzoic acid Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C[N+](=O)[O-])OCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C=C[N+](=O)[O-])OCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H13NO5/c18-16(19)14-7-5-12(6-8-14)11-22-15-4-2-1-3-13(15)9-10-17(20)21/h1-10H,11H2,(H,18,19)