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5-[(5-chloranyl-3-nitro-2-oxidanyl-phenyl)methyl]furan-2-carboxylic acid

5-[(5-chloranyl-3-nitro-2-oxidanyl-phenyl)methyl]furan-2-carboxylic acid

Systemtic Name:5-[(5-chloranyl-3-nitro-2-oxidanyl-phenyl)methyl]furan-2-carboxylic acid
Openeye Name:5-[(5-chloro-2-hydroxy-3-nitro-phenyl)methyl]furan-2-carboxylic acid
CAS Name:5-[(5-chloro-2-hydroxy-3-nitrophenyl)methyl]-2-furancarboxylic acid
IUPAC Name:5-[(5-chloro-2-hydroxy-3-nitrophenyl)methyl]furan-2-carboxylic acid
Traditional Name:5-(5-chloro-2-hydroxy-3-nitro-benzyl)-2-furoic acid
Formula: C12H8ClNO6
MolecularWeight: 297.64802
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)C(=O)O)CC2=CC(=CC(=C2O)[N+](=O)[O-])Cl


Isomeric SMILES

C1=C(OC(=C1)C(=O)O)CC2=CC(=CC(=C2O)[N+](=O)[O-])Cl


InChI

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


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