3-(4-fluoranylphenoxy)propyl 4-(dimethylamino)-3-nitro-benzoate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 4-(dimethylamino)-3-nitro-benzoate Openeye Name: 3-(4-fluorophenoxy)propyl 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid 3-(4-fluorophenoxy)propyl ester Formula: C18H19FN2O5 MolecularWeight: 362.352263

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)OCCCOC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)OCCCOC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C18H19FN2O5/c1-20(2)16-9-4-13(12-17(16)21(23)24)18(22)26-11-3-10-25-15-7-5-14(19)6-8-15/h4-9,12H,3,10-11H2,1-2H3