4-nitro-3-(pyridin-3-ylmethoxy)benzoic acid

Systemtic Name: 4-nitro-3-(pyridin-3-ylmethoxy)benzoic acid Openeye Name: 4-nitro-3-(3-pyridylmethoxy)benzoic acid CAS Name: 4-nitro-3-(3-pyridinylmethoxy)benzoic acid IUPAC Name: 4-nitro-3-(pyridin-3-ylmethoxy)benzoic acid Traditional Name: 4-nitro-3-(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=CC(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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