ethyl 7-tert-butyl-4a-morpholin-4-yl-3-phenyl-6,7,8,8a-tetrahydro-5H-4,1,2-benzoxadiazine-1-carboxylate

Systemtic Name: ethyl 7-tert-butyl-4a-morpholin-4-yl-3-phenyl-6,7,8,8a-tetrahydro-5H-4,1,2-benzoxadiazine-1-carboxylate Openeye Name: ethyl 7-tert-butyl-4a-morpholino-3-phenyl-6,7,8,8a-tetrahydro-5H-4,1,2-benzoxadiazine-1-carboxylate CAS Name: 7-tert-butyl-4a-(4-morpholinyl)-3-phenyl-6,7,8,8a-tetrahydro-5H-4,1,2-benzoxadiazine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 7-tert-butyl-4a-morpholin-4-yl-3-phenyl-6,7,8,8a-tetrahydro-5H-4,1,2-benzoxadiazine-1-carboxylate Traditional Name: 7-tert-butyl-4a-morpholino-3-phenyl-6,7,8,8a-tetrahydro-5H-4,1,2-benzoxadiazine-1-carboxylic acid ethyl ester Formula: C24H35N3O4 MolecularWeight: 429.5524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CC(CCC2(OC(=N1)C3=CC=CC=C3)N4CCOCC4)C(C)(C)C

Isomeric SMILES

CCOC(=O)N1C2CC(CCC2(OC(=N1)C3=CC=CC=C3)N4CCOCC4)C(C)(C)C

InChI

InChI=1S/C24H35N3O4/c1-5-30-22(28)27-20-17-19(23(2,3)4)11-12-24(20,26-13-15-29-16-14-26)31-21(25-27)18-9-7-6-8-10-18/h6-10,19-20H,5,11-17H2,1-4H3