3-(4-fluoranylphenoxy)propyl 2-[[4-(methylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 2-[[4-(methylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: 3-(4-fluorophenoxy)propyl 2-[[4-(methylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(methylamino)-3-nitrophenyl]sulfonylamino]acetic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 2-[[4-(methylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(methylamino)-3-nitro-phenyl]sulfonylamino]acetic acid 3-(4-fluorophenoxy)propyl ester Formula: C18H20FN3O7S MolecularWeight: 441.430703

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCCCOC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCCCOC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C18H20FN3O7S/c1-20-16-8-7-15(11-17(16)22(24)25)30(26,27)21-12-18(23)29-10-2-9-28-14-5-3-13(19)4-6-14/h3-8,11,20-21H,2,9-10,12H2,1H3