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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O6/c1-4-7-8-24-15(19)11-9-12(17(20)21)14(16(5-2)6-3)13(10-11)18(22)23/h9-10H,4-8H2,1-3H3