1-[3,5-bis(oxidanyl)hexyl]-5-(fluoranylmethyl)-N,4-diphenyl-2-propyl-pyrrole-3-carboxamide

Systemtic Name: 1-[3,5-bis(oxidanyl)hexyl]-5-(fluoranylmethyl)-N,4-diphenyl-2-propyl-pyrrole-3-carboxamide Openeye Name: 1-(3,5-dihydroxyhexyl)-5-(fluoromethyl)-N,4-diphenyl-2-propyl-pyrrole-3-carboxamide CAS Name: 1-(3,5-dihydroxyhexyl)-5-(fluoromethyl)-N,4-diphenyl-2-propyl-3-pyrrolecarboxamide IUPAC Name: 1-(3,5-dihydroxyhexyl)-5-(fluoromethyl)-N,4-diphenyl-2-propylpyrrole-3-carboxamide Traditional Name: 1-(3,5-dihydroxyhexyl)-5-(fluoromethyl)-N,4-diphenyl-2-propyl-pyrrole-3-carboxamide Formula: C27H33FN2O3 MolecularWeight: 452.560923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CCC(CC(C)O)O)CF)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C(=C(N1CCC(CC(C)O)O)CF)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C27H33FN2O3/c1-3-10-23-26(27(33)29-21-13-8-5-9-14-21)25(20-11-6-4-7-12-20)24(18-28)30(23)16-15-22(32)17-19(2)31/h4-9,11-14,19,22,31-32H,3,10,15-18H2,1-2H3,(H,29,33)