5-nitro-2-(propan-2-yloxycarbonylamino)benzoic acid

Systemtic Name: 5-nitro-2-(propan-2-yloxycarbonylamino)benzoic acid Openeye Name: 2-(isopropoxycarbonylamino)-5-nitro-benzoic acid CAS Name: 5-nitro-2-[[oxo(propan-2-yloxy)methyl]amino]benzoic acid IUPAC Name: 5-nitro-2-(propan-2-yloxycarbonylamino)benzoic acid Traditional Name: 2-(isopropoxycarbonylamino)-5-nitro-benzoic acid Formula: C11H12N2O6 MolecularWeight: 268.22278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)OC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H12N2O6/c1-6(2)19-11(16)12-9-4-3-7(13(17)18)5-8(9)10(14)15/h3-6H,1-2H3,(H,12,16)(H,14,15)