3-[2,4-bis(fluoranyl)phenyl]-1-(2,2-diethoxyethyl)-1-phenethyl-urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-(2,2-diethoxyethyl)-1-phenethyl-urea Openeye Name: 1-(2,2-diethoxyethyl)-3-(2,4-difluorophenyl)-1-phenethyl-urea CAS Name: 1-(2,2-diethoxyethyl)-3-(2,4-difluorophenyl)-1-phenethylurea IUPAC Name: 1-(2,2-diethoxyethyl)-3-(2,4-difluorophenyl)-1-phenethylurea Traditional Name: 1-(2,2-diethoxyethyl)-3-(2,4-difluorophenyl)-1-phenethyl-urea Formula: C21H26F2N2O3 MolecularWeight: 392.439546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN(CCC1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)F)F)OCC

Isomeric SMILES

CCOC(CN(CCC1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)F)F)OCC

InChI

InChI=1S/C21H26F2N2O3/c1-3-27-20(28-4-2)15-25(13-12-16-8-6-5-7-9-16)21(26)24-19-11-10-17(22)14-18(19)23/h5-11,14,20H,3-4,12-13,15H2,1-2H3,(H,24,26)