ethyl 2-(2,3,5-trimethyl-4,6-dinitro-phenoxy)ethanoate

Systemtic Name: ethyl 2-(2,3,5-trimethyl-4,6-dinitro-phenoxy)ethanoate Openeye Name: ethyl 2-(2,3,5-trimethyl-4,6-dinitro-phenoxy)acetate CAS Name: 2-(2,3,5-trimethyl-4,6-dinitrophenoxy)acetic acid ethyl ester IUPAC Name: ethyl 2-(2,3,5-trimethyl-4,6-dinitrophenoxy)acetate Traditional Name: 2-(2,3,5-trimethyl-4,6-dinitro-phenoxy)acetic acid ethyl ester Formula: C13H16N2O7 MolecularWeight: 312.27534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C(=C(C(=C1C)C)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)COC1=C(C(=C(C(=C1C)C)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O7/c1-5-21-10(16)6-22-13-8(3)7(2)11(14(17)18)9(4)12(13)15(19)20/h5-6H2,1-4H3