2-methylpropyl N-(3-fluoranyl-4-morpholin-4-yl-phenyl)-N-(3-nitro-2-oxidanyl-propyl)carbamate

Systemtic Name: 2-methylpropyl N-(3-fluoranyl-4-morpholin-4-yl-phenyl)-N-(3-nitro-2-oxidanyl-propyl)carbamate Openeye Name: isobutyl N-(3-fluoro-4-morpholino-phenyl)-N-(2-hydroxy-3-nitro-propyl)carbamate CAS Name: N-[3-fluoro-4-(4-morpholinyl)phenyl]-N-(2-hydroxy-3-nitropropyl)carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-(3-fluoro-4-morpholin-4-ylphenyl)-N-(2-hydroxy-3-nitropropyl)carbamate Traditional Name: N-(3-fluoro-4-morpholino-phenyl)-N-(2-hydroxy-3-nitro-propyl)carbamic acid isobutyl ester Formula: C18H26FN3O6 MolecularWeight: 399.413943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26FN3O6/c1-13(2)12-28-18(24)21(10-15(23)11-22(25)26)14-3-4-17(16(19)9-14)20-5-7-27-8-6-20/h3-4,9,13,15,23H,5-8,10-12H2,1-2H3