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

Systemtic Name: methyl 2-(2,3,5-trimethyl-4,6-dinitro-phenoxy)ethanoate Openeye Name: methyl 2-(2,3,5-trimethyl-4,6-dinitro-phenoxy)acetate CAS Name: 2-(2,3,5-trimethyl-4,6-dinitrophenoxy)acetic acid methyl ester IUPAC Name: methyl 2-(2,3,5-trimethyl-4,6-dinitrophenoxy)acetate Traditional Name: 2-(2,3,5-trimethyl-4,6-dinitro-phenoxy)acetic acid methyl ester Formula: C12H14N2O7 MolecularWeight: 298.24876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1[N+](=O)[O-])C)[N+](=O)[O-])OCC(=O)OC)C

Isomeric SMILES

CC1=C(C(=C(C(=C1[N+](=O)[O-])C)[N+](=O)[O-])OCC(=O)OC)C

InChI

InChI=1S/C12H14N2O7/c1-6-7(2)12(21-5-9(15)20-4)11(14(18)19)8(3)10(6)13(16)17/h5H2,1-4H3