4-[[[2,4-bis(fluoranyl)-5-nitro-phenyl]amino]methyl]benzene-1,2-diol

Systemtic Name: 4-[[[2,4-bis(fluoranyl)-5-nitro-phenyl]amino]methyl]benzene-1,2-diol Openeye Name: 4-[(2,4-difluoro-5-nitro-anilino)methyl]benzene-1,2-diol CAS Name: 4-[(2,4-difluoro-5-nitroanilino)methyl]benzene-1,2-diol IUPAC Name: 4-[(2,4-difluoro-5-nitroanilino)methyl]benzene-1,2-diol Traditional Name: 4-[(2,4-difluoro-5-nitro-anilino)methyl]pyrocatechol Formula: C13H10F2N2O4 MolecularWeight: 296.226306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC2=CC(=C(C=C2F)F)[N+](=O)[O-])O)O

Isomeric SMILES

C1=CC(=C(C=C1CNC2=CC(=C(C=C2F)F)[N+](=O)[O-])O)O

InChI

InChI=1S/C13H10F2N2O4/c14-8-4-9(15)11(17(20)21)5-10(8)16-6-7-1-2-12(18)13(19)3-7/h1-5,16,18-19H,6H2