(6-nitro-1,3-benzodioxol-5-yl)methyl 4-fluoranylbenzoate

Systemtic Name: (6-nitro-1,3-benzodioxol-5-yl)methyl 4-fluoranylbenzoate Openeye Name: (6-nitro-1,3-benzodioxol-5-yl)methyl 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid (6-nitro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-nitro-1,3-benzodioxol-5-yl)methyl 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid (6-nitro-1,3-benzodioxol-5-yl)methyl ester Formula: C15H10FNO6 MolecularWeight: 319.241403

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C15H10FNO6/c16-11-3-1-9(2-4-11)15(18)21-7-10-5-13-14(23-8-22-13)6-12(10)17(19)20/h1-6H,7-8H2