2-nitro-6-(pyridin-3-ylmethoxycarbonyl)benzoic acid

Systemtic Name: 2-nitro-6-(pyridin-3-ylmethoxycarbonyl)benzoic acid Openeye Name: 2-nitro-6-(3-pyridylmethoxycarbonyl)benzoic acid CAS Name: 2-nitro-6-[oxo(3-pyridinylmethoxy)methyl]benzoic acid IUPAC Name: 2-nitro-6-(pyridin-3-ylmethoxycarbonyl)benzoic acid Traditional Name: 2-nitro-6-(3-pyridylmethoxycarbonyl)benzoic acid Formula: C14H10N2O6 MolecularWeight: 302.239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)OCC2=CN=CC=C2

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)OCC2=CN=CC=C2

InChI

InChI=1S/C14H10N2O6/c17-13(18)12-10(4-1-5-11(12)16(20)21)14(19)22-8-9-3-2-6-15-7-9/h1-7H,8H2,(H,17,18)