dimethyl 1-(4-methylphenyl)-5,5-bis(trifluoromethyl)-2H-pyrrole-3,4-dicarboxylate

Systemtic Name: dimethyl 1-(4-methylphenyl)-5,5-bis(trifluoromethyl)-2H-pyrrole-3,4-dicarboxylate Openeye Name: dimethyl 1-(p-tolyl)-5,5-bis(trifluoromethyl)-2H-pyrrole-3,4-dicarboxylate CAS Name: 1-(4-methylphenyl)-5,5-bis(trifluoromethyl)-2H-pyrrole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(4-methylphenyl)-5,5-bis(trifluoromethyl)-2H-pyrrole-3,4-dicarboxylate Traditional Name: 1-(p-tolyl)-2,2-bis(trifluoromethyl)-3-pyrroline-3,4-dicarboxylic acid dimethyl ester Formula: C17H15F6NO4 MolecularWeight: 411.295719

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(=C(C2(C(F)(F)F)C(F)(F)F)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(=C(C2(C(F)(F)F)C(F)(F)F)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H15F6NO4/c1-9-4-6-10(7-5-9)24-8-11(13(25)27-2)12(14(26)28-3)15(24,16(18,19)20)17(21,22)23/h4-7H,8H2,1-3H3