tert-butyl 4-(diethylamino)-3,5-dinitro-benzoate

Systemtic Name: tert-butyl 4-(diethylamino)-3,5-dinitro-benzoate Openeye Name: tert-butyl 4-(diethylamino)-3,5-dinitro-benzoate CAS Name: 4-(diethylamino)-3,5-dinitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(diethylamino)-3,5-dinitrobenzoate Traditional Name: 4-(diethylamino)-3,5-dinitro-benzoic acid tert-butyl ester Formula: C15H21N3O6 MolecularWeight: 339.34374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O6/c1-6-16(7-2)13-11(17(20)21)8-10(9-12(13)18(22)23)14(19)24-15(3,4)5/h8-9H,6-7H2,1-5H3