tert-butyl 2-(2,4-dinitrophenyl)-3,4-dinitro-5-oxidanyl-benzoate

Systemtic Name: tert-butyl 2-(2,4-dinitrophenyl)-3,4-dinitro-5-oxidanyl-benzoate Openeye Name: tert-butyl 2-(2,4-dinitrophenyl)-5-hydroxy-3,4-dinitro-benzoate CAS Name: 2-(2,4-dinitrophenyl)-5-hydroxy-3,4-dinitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2,4-dinitrophenyl)-5-hydroxy-3,4-dinitrobenzoate Traditional Name: 2-(2,4-dinitrophenyl)-5-hydroxy-3,4-dinitro-benzoic acid tert-butyl ester Formula: C17H14N4O11 MolecularWeight: 450.31326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C(=C1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C17H14N4O11/c1-17(2,3)32-16(23)10-7-12(22)14(20(28)29)15(21(30)31)13(10)9-5-4-8(18(24)25)6-11(9)19(26)27/h4-7,22H,1-3H3