3-(3-nitro-4-oxidanidyl-phenyl)propanoate

Systemtic Name: 3-(3-nitro-4-oxidanidyl-phenyl)propanoate Openeye Name: 3-(3-nitro-4-oxido-phenyl)propanoate CAS Name: 3-(3-nitro-4-oxidophenyl)propanoate IUPAC Name: 3-(3-nitro-4-oxidophenyl)propanoate Traditional Name: 3-(3-nitro-4-oxido-phenyl)propionate Formula: C9H7NO5-2 MolecularWeight: 209.15558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC(=O)[O-])[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC(=C(C=C1CCC(=O)[O-])[N+](=O)[O-])[O-]

InChI

InChI=1S/C9H9NO5/c11-8-3-1-6(2-4-9(12)13)5-7(8)10(14)15/h1,3,5,11H,2,4H2,(H,12,13)/p-2