1-(2,2-diethoxyethyl)-3-(4-iodophenyl)-1-phenethyl-urea

Systemtic Name: 1-(2,2-diethoxyethyl)-3-(4-iodophenyl)-1-phenethyl-urea Openeye Name: 1-(2,2-diethoxyethyl)-3-(4-iodophenyl)-1-phenethyl-urea CAS Name: 1-(2,2-diethoxyethyl)-3-(4-iodophenyl)-1-phenethylurea IUPAC Name: 1-(2,2-diethoxyethyl)-3-(4-iodophenyl)-1-phenethylurea Traditional Name: 1-(2,2-diethoxyethyl)-3-(4-iodophenyl)-1-phenethyl-urea Formula: C21H27IN2O3 MolecularWeight: 482.35515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27IN2O3/c1-3-26-20(27-4-2)16-24(15-14-17-8-6-5-7-9-17)21(25)23-19-12-10-18(22)11-13-19/h5-13,20H,3-4,14-16H2,1-2H3,(H,23,25)