ethyl 4a-morpholin-4-yl-3-(4-nitrophenyl)-5-oxidanylidene-6,7,8,8a-tetrahydro-4,1,2-benzoxadiazine-1-carboxylate

Systemtic Name: ethyl 4a-morpholin-4-yl-3-(4-nitrophenyl)-5-oxidanylidene-6,7,8,8a-tetrahydro-4,1,2-benzoxadiazine-1-carboxylate Openeye Name: ethyl 4a-morpholino-3-(4-nitrophenyl)-5-oxo-6,7,8,8a-tetrahydro-4,1,2-benzoxadiazine-1-carboxylate CAS Name: 4a-(4-morpholinyl)-3-(4-nitrophenyl)-5-oxo-6,7,8,8a-tetrahydro-4,1,2-benzoxadiazine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4a-morpholin-4-yl-3-(4-nitrophenyl)-5-oxo-6,7,8,8a-tetrahydro-4,1,2-benzoxadiazine-1-carboxylate Traditional Name: 5-keto-4a-morpholino-3-(4-nitrophenyl)-6,7,8,8a-tetrahydro-4,1,2-benzoxadiazine-1-carboxylic acid ethyl ester Formula: C20H24N4O7 MolecularWeight: 432.42716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CCCC(=O)C2(OC(=N1)C3=CC=C(C=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

CCOC(=O)N1C2CCCC(=O)C2(OC(=N1)C3=CC=C(C=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C20H24N4O7/c1-2-30-19(26)23-16-4-3-5-17(25)20(16,22-10-12-29-13-11-22)31-18(21-23)14-6-8-15(9-7-14)24(27)28/h6-9,16H,2-5,10-13H2,1H3