2-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(2,2-difluoro-1,3-benzodioxol-5-yl)iminomethyl]-4-nitro-phenolate Formula: C14H7F2N2O5- MolecularWeight: 321.212586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])OC(O2)(F)F

InChI

InChI=1S/C14H8F2N2O5/c15-14(16)22-12-4-1-9(6-13(12)23-14)17-7-8-5-10(18(20)21)2-3-11(8)19/h1-7,19H/p-1