(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(3-fluoranyl-4-methoxy-phenyl)ethanoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(3-fluoranyl-4-methoxy-phenyl)ethanoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(3-fluoro-4-methoxy-phenyl)acetate CAS Name: 2-(3-fluoro-4-methoxyphenyl)acetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(3-fluoro-4-methoxyphenyl)acetate Traditional Name: 2-(3-fluoro-4-methoxy-phenyl)acetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H16FNO7 MolecularWeight: 377.320543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)F

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)F

InChI

InChI=1S/C18H16FNO7/c1-24-16-3-2-11(4-15(16)19)5-17(21)26-9-13-7-14(20(22)23)6-12-8-25-10-27-18(12)13/h2-4,6-7H,5,8-10H2,1H3