(2-fluorophenyl)methyl 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: (2-fluorophenyl)methyl 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: (2-fluorophenyl)methyl 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid (2-fluorophenyl)methyl ester IUPAC Name: (2-fluorophenyl)methyl 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid (2-fluorobenzyl) ester Formula: C17H16FNO6 MolecularWeight: 349.310443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OCC2=CC=CC=C2F)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OCC2=CC=CC=C2F)[N+](=O)[O-])OC

InChI

InChI=1S/C17H16FNO6/c1-3-24-16-8-12(14(19(21)22)9-15(16)23-2)17(20)25-10-11-6-4-5-7-13(11)18/h4-9H,3,10H2,1-2H3