[2,3-bis(fluoranyl)phenyl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: [2,3-bis(fluoranyl)phenyl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: (2,3-difluorophenyl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid (2,3-difluorophenyl)methyl ester IUPAC Name: (2,3-difluorophenyl)methyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid (2,3-difluorobenzyl) ester Formula: C13H10F2N2O4 MolecularWeight: 296.226306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=C(C(=CC=C2)F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=C(C(=CC=C2)F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H10F2N2O4/c1-16-6-9(17(19)20)5-11(16)13(18)21-7-8-3-2-4-10(14)12(8)15/h2-6H,7H2,1H3