2-methyl-1-(3-methylbutyl)-5-pentyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Openeye Name: 1-isopentyl-2-methyl-5-pentyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide CAS Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-[4-(trifluoromethyl)phenyl]-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Traditional Name: 5-amyl-1-isoamyl-2-methyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Formula: C23H31F3N2O MolecularWeight: 408.50025

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C23H31F3N2O/c1-5-6-7-8-19-21(17-9-11-18(12-10-17)23(24,25)26)20(22(27)29)16(4)28(19)14-13-15(2)3/h9-12,15H,5-8,13-14H2,1-4H3,(H2,27,29)