2-nitro-4-oxidanyl-5-(oxolan-2-ylmethoxy)benzoic acid

Systemtic Name: 2-nitro-4-oxidanyl-5-(oxolan-2-ylmethoxy)benzoic acid Openeye Name: 4-hydroxy-2-nitro-5-(tetrahydrofuran-2-ylmethoxy)benzoic acid CAS Name: 4-hydroxy-2-nitro-5-(2-oxolanylmethoxy)benzoic acid IUPAC Name: 4-hydroxy-2-nitro-5-(oxolan-2-ylmethoxy)benzoic acid Traditional Name: 4-hydroxy-2-nitro-5-(tetrahydrofurfuryloxy)benzoic acid Formula: C12H13NO7 MolecularWeight: 283.23412

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=C(C=C(C(=C2)C(=O)O)[N+](=O)[O-])O

Isomeric SMILES

C1CC(OC1)COC2=C(C=C(C(=C2)C(=O)O)[N+](=O)[O-])O

InChI

InChI=1S/C12H13NO7/c14-10-5-9(13(17)18)8(12(15)16)4-11(10)20-6-7-2-1-3-19-7/h4-5,7,14H,1-3,6H2,(H,15,16)