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

Systemtic Name: methyl 4-[bis(fluoranyl)methyl]-2-(4-nitrophenyl)-1-phenyl-pyrrole-3-carboxylate Openeye Name: methyl 4-(difluoromethyl)-2-(4-nitrophenyl)-1-phenyl-pyrrole-3-carboxylate CAS Name: 4-(difluoromethyl)-2-(4-nitrophenyl)-1-phenyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(difluoromethyl)-2-(4-nitrophenyl)-1-phenylpyrrole-3-carboxylate Traditional Name: 4-(difluoromethyl)-2-(4-nitrophenyl)-1-phenyl-pyrrole-3-carboxylic acid methyl ester Formula: C19H14F2N2O4 MolecularWeight: 372.322266

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C=C1C(F)F)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(N(C=C1C(F)F)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H14F2N2O4/c1-27-19(24)16-15(18(20)21)11-22(13-5-3-2-4-6-13)17(16)12-7-9-14(10-8-12)23(25)26/h2-11,18H,1H3