[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: [1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: [1-(difluoromethyl)benzimidazol-2-yl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid [1-(difluoromethyl)-2-benzimidazolyl]methyl ester IUPAC Name: [1-(difluoromethyl)benzimidazol-2-yl]methyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid [1-(difluoromethyl)benzimidazol-2-yl]methyl ester Formula: C15H12F2N4O4 MolecularWeight: 350.276986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=NC3=CC=CC=C3N2C(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=NC3=CC=CC=C3N2C(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H12F2N4O4/c1-19-7-9(21(23)24)6-12(19)14(22)25-8-13-18-10-4-2-3-5-11(10)20(13)15(16)17/h2-7,15H,8H2,1H3