3-[(2-chloranyl-4-nitro-phenoxy)methyl]furan-2-carboxylic acid

Systemtic Name: 3-[(2-chloranyl-4-nitro-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 3-[(2-chloro-4-nitro-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 3-[(2-chloro-4-nitrophenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 3-[(2-chloro-4-nitrophenoxy)methyl]furan-2-carboxylic acid Traditional Name: 3-[(2-chloro-4-nitro-phenoxy)methyl]-2-furoic acid Formula: C12H8ClNO6 MolecularWeight: 297.64802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8ClNO6/c13-9-5-8(14(17)18)1-2-10(9)20-6-7-3-4-19-11(7)12(15)16/h1-5H,6H2,(H,15,16)