N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrrole-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrrole-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrrole-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-fluorophenyl)methyl]-3,5-dimethyl-2-pyrrolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-fluorophenyl)methyl]-3,5-dimethylpyrrole-2-carboxamide Traditional Name: 1-(2-fluorobenzyl)-3,5-dimethyl-N-piperonyl-pyrrole-2-carboxamide Formula: C22H21FN2O3 MolecularWeight: 380.412143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2F)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2F)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H21FN2O3/c1-14-9-15(2)25(12-17-5-3-4-6-18(17)23)21(14)22(26)24-11-16-7-8-19-20(10-16)28-13-27-19/h3-10H,11-13H2,1-2H3,(H,24,26)