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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-[4-(trifluoromethyl)phenyl]-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Traditional Name: 2-methyl-1-piperonyl-5-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Formula: C21H17F3N2O3 MolecularWeight: 402.36649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)C(F)(F)F)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)C(F)(F)F)C(=O)N

InChI

InChI=1S/C21H17F3N2O3/c1-12-16(20(25)27)9-17(14-3-5-15(6-4-14)21(22,23)24)26(12)10-13-2-7-18-19(8-13)29-11-28-18/h2-9H,10-11H2,1H3,(H2,25,27)