hexyl 1,2-diphenyl-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: hexyl 1,2-diphenyl-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: hexyl 1,2-diphenyl-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: 1,2-diphenyl-4-(trifluoromethyl)-3-pyrrolecarboxylic acid hexyl ester IUPAC Name: hexyl 1,2-diphenyl-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: 1,2-diphenyl-4-(trifluoromethyl)pyrrole-3-carboxylic acid hexyl ester Formula: C24H24F3NO2 MolecularWeight: 415.44807

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(N(C=C1C(F)(F)F)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC(=O)C1=C(N(C=C1C(F)(F)F)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H24F3NO2/c1-2-3-4-11-16-30-23(29)21-20(24(25,26)27)17-28(19-14-9-6-10-15-19)22(21)18-12-7-5-8-13-18/h5-10,12-15,17H,2-4,11,16H2,1H3