[(2R)-3-fluoranyl-2-(4-nitrophenyl)carbonyloxy-dec-4-ynyl] 4-nitrobenzoate

Systemtic Name: [(2R)-3-fluoranyl-2-(4-nitrophenyl)carbonyloxy-dec-4-ynyl] 4-nitrobenzoate Openeye Name: [(2R)-3-fluoro-2-(4-nitrobenzoyl)oxy-dec-4-ynyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2R)-3-fluoro-2-[(4-nitrophenyl)-oxomethoxy]dec-4-ynyl] ester IUPAC Name: [(2R)-3-fluoro-2-(4-nitrobenzoyl)oxydec-4-ynyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2R)-3-fluoro-2-(4-nitrobenzoyl)oxy-dec-4-ynyl] ester Formula: C24H23FN2O8 MolecularWeight: 486.446423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC(C(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

CCCCCC#CC([C@@H](COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C24H23FN2O8/c1-2-3-4-5-6-7-21(25)22(35-24(29)18-10-14-20(15-11-18)27(32)33)16-34-23(28)17-8-12-19(13-9-17)26(30)31/h8-15,21-22H,2-5,16H2,1H3/t21?,22-/m1/s1