2-(2-fluoranylphenoxy)ethyl 2-[[4-(furan-2-ylmethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: 2-(2-fluoranylphenoxy)ethyl 2-[[4-(furan-2-ylmethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: 2-(2-fluorophenoxy)ethyl 2-[[4-(2-furylmethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(2-furanylmethylamino)-3-nitrophenyl]sulfonylamino]acetic acid 2-(2-fluorophenoxy)ethyl ester IUPAC Name: 2-(2-fluorophenoxy)ethyl 2-[[4-(furan-2-ylmethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(2-furfurylamino)-3-nitro-phenyl]sulfonylamino]acetic acid 2-(2-fluorophenoxy)ethyl ester Formula: C21H20FN3O8S MolecularWeight: 493.462203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCOC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CO3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)OCCOC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CO3)[N+](=O)[O-])F

InChI

InChI=1S/C21H20FN3O8S/c22-17-5-1-2-6-20(17)32-10-11-33-21(26)14-24-34(29,30)16-7-8-18(19(12-16)25(27)28)23-13-15-4-3-9-31-15/h1-9,12,23-24H,10-11,13-14H2