(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(4-fluorophenyl)propanoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(4-fluorophenyl)propanoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(4-fluorophenyl)propanoate CAS Name: 3-(4-fluorophenyl)propanoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(4-fluorophenyl)propanoate Traditional Name: 3-(4-fluorophenyl)propionic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H16FNO6 MolecularWeight: 361.321143

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)CCC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)CCC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H16FNO6/c19-15-4-1-12(2-5-15)3-6-17(21)25-10-14-8-16(20(22)23)7-13-9-24-11-26-18(13)14/h1-2,4-5,7-8H,3,6,9-11H2