ethyl 4-morpholin-4-yl-3,5-dinitro-benzoate

Systemtic Name: ethyl 4-morpholin-4-yl-3,5-dinitro-benzoate Openeye Name: ethyl 4-morpholino-3,5-dinitro-benzoate CAS Name: 4-(4-morpholinyl)-3,5-dinitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-morpholin-4-yl-3,5-dinitrobenzoate Traditional Name: 4-morpholino-3,5-dinitro-benzoic acid ethyl ester Formula: C13H15N3O7 MolecularWeight: 325.2741

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O7/c1-2-23-13(17)9-7-10(15(18)19)12(11(8-9)16(20)21)14-3-5-22-6-4-14/h7-8H,2-6H2,1H3