1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-[3-(trifluoromethyloxy)phenyl]pyrrole-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-[3-(trifluoromethyloxy)phenyl]pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-[3-(trifluoromethoxy)phenyl]pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-[3-(trifluoromethoxy)phenyl]-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-[3-(trifluoromethoxy)phenyl]pyrrole-3-carboxamide Traditional Name: 5-ethyl-2-methyl-1-piperonyl-4-[3-(trifluoromethoxy)phenyl]pyrrole-3-carboxamide Formula: C23H21F3N2O4 MolecularWeight: 446.41905

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=CC(=CC=C4)OC(F)(F)F

Isomeric SMILES

CCC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=CC(=CC=C4)OC(F)(F)F

InChI

InChI=1S/C23H21F3N2O4/c1-3-17-21(15-5-4-6-16(10-15)32-23(24,25)26)20(22(27)29)13(2)28(17)11-14-7-8-18-19(9-14)31-12-30-18/h4-10H,3,11-12H2,1-2H3,(H2,27,29)