tert-butyl N-[3-(5-cyano-2-iodanyl-phenoxy)propyl]carbamate

Systemtic Name: tert-butyl N-[3-(5-cyano-2-iodanyl-phenoxy)propyl]carbamate Openeye Name: tert-butyl N-[3-(5-cyano-2-iodo-phenoxy)propyl]carbamate CAS Name: N-[3-(5-cyano-2-iodophenoxy)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(5-cyano-2-iodophenoxy)propyl]carbamate Traditional Name: N-[3-(5-cyano-2-iodo-phenoxy)propyl]carbamic acid tert-butyl ester Formula: C15H19IN2O3 MolecularWeight: 402.22743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCOC1=C(C=CC(=C1)C#N)I

Isomeric SMILES

CC(C)(C)OC(=O)NCCCOC1=C(C=CC(=C1)C#N)I

InChI

InChI=1S/C15H19IN2O3/c1-15(2,3)21-14(19)18-7-4-8-20-13-9-11(10-17)5-6-12(13)16/h5-6,9H,4,7-8H2,1-3H3,(H,18,19)