(3-fluoranyl-4-methoxy-phenyl)methyl 4-ethoxy-5-methoxy-2-nitro-benzoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 4-ethoxy-5-methoxy-2-nitro-benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 4-ethoxy-5-methoxy-2-nitro-benzoate CAS Name: 4-ethoxy-5-methoxy-2-nitrobenzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 4-ethoxy-5-methoxy-2-nitrobenzoate Traditional Name: 4-ethoxy-5-methoxy-2-nitro-benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C18H18FNO7 MolecularWeight: 379.336423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OCC2=CC(=C(C=C2)OC)F)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OCC2=CC(=C(C=C2)OC)F)OC

InChI

InChI=1S/C18H18FNO7/c1-4-26-17-9-14(20(22)23)12(8-16(17)25-3)18(21)27-10-11-5-6-15(24-2)13(19)7-11/h5-9H,4,10H2,1-3H3