ethyl 1-[[2,6-bis(fluoranyl)phenyl]methyl]-4-nitro-pyrrole-2-carboxylate

Systemtic Name: ethyl 1-[[2,6-bis(fluoranyl)phenyl]methyl]-4-nitro-pyrrole-2-carboxylate Openeye Name: ethyl 1-[(2,6-difluorophenyl)methyl]-4-nitro-pyrrole-2-carboxylate CAS Name: 1-[(2,6-difluorophenyl)methyl]-4-nitro-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2,6-difluorophenyl)methyl]-4-nitropyrrole-2-carboxylate Traditional Name: 1-(2,6-difluorobenzyl)-4-nitro-pyrrole-2-carboxylic acid ethyl ester Formula: C14H12F2N2O4 MolecularWeight: 310.252886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1CC2=C(C=CC=C2F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CN1CC2=C(C=CC=C2F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H12F2N2O4/c1-2-22-14(19)13-6-9(18(20)21)7-17(13)8-10-11(15)4-3-5-12(10)16/h3-7H,2,8H2,1H3