(2-methoxy-5-nitro-phenyl)methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid (2-methoxy-5-nitro-benzyl) ester Formula: C19H19FN2O8S MolecularWeight: 454.426163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H19FN2O8S/c1-28-17-5-3-15(22(24)25)10-14(17)12-30-19(23)13-2-4-16(20)18(11-13)31(26,27)21-6-8-29-9-7-21/h2-5,10-11H,6-9,12H2,1H3