(3-fluorophenyl)methyl 2-(dimethylamino)-5-nitro-benzoate

Systemtic Name: (3-fluorophenyl)methyl 2-(dimethylamino)-5-nitro-benzoate Openeye Name: (3-fluorophenyl)methyl 2-(dimethylamino)-5-nitro-benzoate CAS Name: 2-(dimethylamino)-5-nitrobenzoic acid (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl 2-(dimethylamino)-5-nitrobenzoate Traditional Name: 2-(dimethylamino)-5-nitro-benzoic acid (3-fluorobenzyl) ester Formula: C16H15FN2O4 MolecularWeight: 318.299703

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC(=CC=C2)F

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC(=CC=C2)F

InChI

InChI=1S/C16H15FN2O4/c1-18(2)15-7-6-13(19(21)22)9-14(15)16(20)23-10-11-4-3-5-12(17)8-11/h3-9H,10H2,1-2H3