3-(4-fluoranylphenoxy)propyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: 3-(4-fluorophenoxy)propyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid 3-(4-fluorophenoxy)propyl ester Formula: C20H21FN2O6 MolecularWeight: 404.388943

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCCCOC3=CC=C(C=C3)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2O6/c21-15-2-5-17(6-3-15)28-10-1-11-29-20(24)18-14-16(23(25)26)4-7-19(18)22-8-12-27-13-9-22/h2-7,14H,1,8-13H2