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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2F)C)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2F)C)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

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