[2-oxidanylidene-2-[[2,4,6-tris(iodanyl)phenyl]amino]ethyl] 3-cyclohexylpropanoate

Systemtic Name: [2-oxidanylidene-2-[[2,4,6-tris(iodanyl)phenyl]amino]ethyl] 3-cyclohexylpropanoate Openeye Name: [2-oxo-2-(2,4,6-triiodoanilino)ethyl] 3-cyclohexylpropanoate CAS Name: 3-cyclohexylpropanoic acid [2-oxo-2-(2,4,6-triiodoanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-triiodoanilino)ethyl] 3-cyclohexylpropanoate Traditional Name: 3-cyclohexylpropionic acid [2-keto-2-(2,4,6-triiodoanilino)ethyl] ester Formula: C17H20I3NO3 MolecularWeight: 667.05901

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)OCC(=O)NC2=C(C=C(C=C2I)I)I

Isomeric SMILES

C1CCC(CC1)CCC(=O)OCC(=O)NC2=C(C=C(C=C2I)I)I

InChI

InChI=1S/C17H20I3NO3/c18-12-8-13(19)17(14(20)9-12)21-15(22)10-24-16(23)7-6-11-4-2-1-3-5-11/h8-9,11H,1-7,10H2,(H,21,22)