2-(4-methoxy-2-nitro-5-oxidanyl-phenyl)ethyl ethanoate

Systemtic Name: 2-(4-methoxy-2-nitro-5-oxidanyl-phenyl)ethyl ethanoate Openeye Name: 2-(5-hydroxy-4-methoxy-2-nitro-phenyl)ethyl acetate CAS Name: acetic acid 2-(5-hydroxy-4-methoxy-2-nitrophenyl)ethyl ester IUPAC Name: 2-(5-hydroxy-4-methoxy-2-nitrophenyl)ethyl acetate Traditional Name: acetic acid 2-(5-hydroxy-4-methoxy-2-nitro-phenyl)ethyl ester Formula: C11H13NO6 MolecularWeight: 255.22402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1=CC(=C(C=C1[N+](=O)[O-])OC)O

Isomeric SMILES

CC(=O)OCCC1=CC(=C(C=C1[N+](=O)[O-])OC)O

InChI

InChI=1S/C11H13NO6/c1-7(13)18-4-3-8-5-10(14)11(17-2)6-9(8)12(15)16/h5-6,14H,3-4H2,1-2H3