3-(5-methoxy-2-nitro-phenoxy)-3-oxidanylidene-propanoate

Systemtic Name: 3-(5-methoxy-2-nitro-phenoxy)-3-oxidanylidene-propanoate Openeye Name: 3-(5-methoxy-2-nitro-phenoxy)-3-oxo-propanoate CAS Name: 3-(5-methoxy-2-nitrophenoxy)-3-oxopropanoate IUPAC Name: 3-(5-methoxy-2-nitrophenoxy)-3-oxopropanoate Traditional Name: 3-keto-3-(5-methoxy-2-nitro-phenoxy)propionate Formula: C10H8NO7- MolecularWeight: 254.17302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)[N+](=O)[O-])OC(=O)CC(=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)[N+](=O)[O-])OC(=O)CC(=O)[O-]

InChI

InChI=1S/C10H9NO7/c1-17-6-2-3-7(11(15)16)8(4-6)18-10(14)5-9(12)13/h2-4H,5H2,1H3,(H,12,13)/p-1