5-[(2-chloranyl-4-cyano-phenoxy)methyl]furan-2-carboxylic acid

Systemtic Name: 5-[(2-chloranyl-4-cyano-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 5-[(2-chloro-4-cyano-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 5-[(2-chloro-4-cyanophenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(2-chloro-4-cyanophenoxy)methyl]furan-2-carboxylic acid Traditional Name: 5-[(2-chloro-4-cyano-phenoxy)methyl]-2-furoic acid Formula: C13H8ClNO4 MolecularWeight: 277.65992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)Cl)OCC2=CC=C(O2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C#N)Cl)OCC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C13H8ClNO4/c14-10-5-8(6-15)1-3-11(10)18-7-9-2-4-12(19-9)13(16)17/h1-5H,7H2,(H,16,17)