3-nitro-4-(phenylcarbonyl)-5-(pyridin-2-ylmethoxy)benzoic acid

Systemtic Name: 3-nitro-4-(phenylcarbonyl)-5-(pyridin-2-ylmethoxy)benzoic acid Openeye Name: 4-benzoyl-3-nitro-5-(2-pyridylmethoxy)benzoic acid CAS Name: 4-benzoyl-3-nitro-5-(2-pyridinylmethoxy)benzoic acid IUPAC Name: 4-benzoyl-3-nitro-5-(pyridin-2-ylmethoxy)benzoic acid Traditional Name: 4-benzoyl-3-nitro-5-(2-pyridylmethoxy)benzoic acid Formula: C20H14N2O6 MolecularWeight: 378.33496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2OCC3=CC=CC=N3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2OCC3=CC=CC=N3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C20H14N2O6/c23-19(13-6-2-1-3-7-13)18-16(22(26)27)10-14(20(24)25)11-17(18)28-12-15-8-4-5-9-21-15/h1-11H,12H2,(H,24,25)