3-nitro-4-[[(2R)-oxan-2-yl]methoxy]benzoic acid

Systemtic Name: 3-nitro-4-[[(2R)-oxan-2-yl]methoxy]benzoic acid Openeye Name: 3-nitro-4-[[(2R)-tetrahydropyran-2-yl]methoxy]benzoic acid CAS Name: 3-nitro-4-[[(2R)-2-oxanyl]methoxy]benzoic acid IUPAC Name: 3-nitro-4-[[(2R)-oxan-2-yl]methoxy]benzoic acid Traditional Name: 3-nitro-4-[[(2R)-tetrahydropyran-2-yl]methoxy]benzoic acid Formula: C13H15NO6 MolecularWeight: 281.2613

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)COC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCO[C@H](C1)COC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H15NO6/c15-13(16)9-4-5-12(11(7-9)14(17)18)20-8-10-3-1-2-6-19-10/h4-5,7,10H,1-3,6,8H2,(H,15,16)/t10-/m1/s1