5-nitro-2-(pyridin-3-ylmethoxy)benzoic acid

Systemtic Name: 5-nitro-2-(pyridin-3-ylmethoxy)benzoic acid Openeye Name: 5-nitro-2-(3-pyridylmethoxy)benzoic acid CAS Name: 5-nitro-2-(3-pyridinylmethoxy)benzoic acid IUPAC Name: 5-nitro-2-(pyridin-3-ylmethoxy)benzoic acid Traditional Name: 5-nitro-2-(3-pyridylmethoxy)benzoic acid Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H10N2O5/c16-13(17)11-6-10(15(18)19)3-4-12(11)20-8-9-2-1-5-14-7-9/h1-7H,8H2,(H,16,17)