(6-tert-butyl-3-methyl-2,4-dinitro-phenyl) ethanoate

Systemtic Name: (6-tert-butyl-3-methyl-2,4-dinitro-phenyl) ethanoate Openeye Name: (6-tert-butyl-3-methyl-2,4-dinitro-phenyl) acetate CAS Name: acetic acid (6-tert-butyl-3-methyl-2,4-dinitrophenyl) ester IUPAC Name: (6-tert-butyl-3-methyl-2,4-dinitrophenyl) acetate Traditional Name: acetic acid (6-tert-butyl-3-methyl-2,4-dinitro-phenyl) ester Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O6/c1-7-10(14(17)18)6-9(13(3,4)5)12(21-8(2)16)11(7)15(19)20/h6H,1-5H3