2-(cyclohexylcarbamoyloxy)ethyl 3-acetamido-2,4,6-tris(iodanyl)benzoate

Systemtic Name: 2-(cyclohexylcarbamoyloxy)ethyl 3-acetamido-2,4,6-tris(iodanyl)benzoate Openeye Name: 2-(cyclohexylcarbamoyloxy)ethyl 3-acetamido-2,4,6-triiodo-benzoate CAS Name: 3-acetamido-2,4,6-triiodobenzoic acid 2-[(cyclohexylamino)-oxomethoxy]ethyl ester IUPAC Name: 2-(cyclohexylcarbamoyloxy)ethyl 3-acetamido-2,4,6-triiodobenzoate Traditional Name: 3-acetamido-2,4,6-triiodo-benzoic acid 2-(cyclohexylcarbamoyloxy)ethyl ester Formula: C18H21I3N2O5 MolecularWeight: 726.08315

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1I)C(=O)OCCOC(=O)NC2CCCCC2)I)I

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1I)C(=O)OCCOC(=O)NC2CCCCC2)I)I

InChI

InChI=1S/C18H21I3N2O5/c1-10(24)22-16-13(20)9-12(19)14(15(16)21)17(25)27-7-8-28-18(26)23-11-5-3-2-4-6-11/h9,11H,2-8H2,1H3,(H,22,24)(H,23,26)