ethyl 2-methyl-3,5-dinitro-benzoate

Systemtic Name: ethyl 2-methyl-3,5-dinitro-benzoate Openeye Name: ethyl 2-methyl-3,5-dinitro-benzoate CAS Name: 2-methyl-3,5-dinitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3,5-dinitrobenzoate Traditional Name: 2-methyl-3,5-dinitro-benzoic acid ethyl ester Formula: C10H10N2O6 MolecularWeight: 254.1962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H10N2O6/c1-3-18-10(13)8-4-7(11(14)15)5-9(6(8)2)12(16)17/h4-5H,3H2,1-2H3