N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxamide Formula: C22H21FN2O3 MolecularWeight: 380.412143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)NC(C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)NC(C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H21FN2O3/c1-13-10-19(15(3)25(13)18-7-5-17(23)6-8-18)22(26)24-14(2)16-4-9-20-21(11-16)28-12-27-20/h4-11,14H,12H2,1-3H3,(H,24,26)