tert-butyl N-[2-(5-cyano-2-iodanyl-phenoxy)ethyl]carbamate

Systemtic Name: tert-butyl N-[2-(5-cyano-2-iodanyl-phenoxy)ethyl]carbamate Openeye Name: tert-butyl N-[2-(5-cyano-2-iodo-phenoxy)ethyl]carbamate CAS Name: N-[2-(5-cyano-2-iodophenoxy)ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(5-cyano-2-iodophenoxy)ethyl]carbamate Traditional Name: N-[2-(5-cyano-2-iodo-phenoxy)ethyl]carbamic acid tert-butyl ester Formula: C14H17IN2O3 MolecularWeight: 388.20085

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCOC1=C(C=CC(=C1)C#N)I

Isomeric SMILES

CC(C)(C)OC(=O)NCCOC1=C(C=CC(=C1)C#N)I

InChI

InChI=1S/C14H17IN2O3/c1-14(2,3)20-13(18)17-6-7-19-12-8-10(9-16)4-5-11(12)15/h4-5,8H,6-7H2,1-3H3,(H,17,18)