(2S)-3-(4-azanylphenoxy)-N-(4-cyano-3-iodanyl-phenyl)-2-methyl-2-oxidanyl-propanamide

Systemtic Name: (2S)-3-(4-azanylphenoxy)-N-(4-cyano-3-iodanyl-phenyl)-2-methyl-2-oxidanyl-propanamide Openeye Name: (2S)-3-(4-aminophenoxy)-N-(4-cyano-3-iodanyl-phenyl)-2-hydroxy-2-methyl-propanamide CAS Name: (2S)-3-(4-aminophenoxy)-N-(4-cyano-3-iodanylphenyl)-2-hydroxy-2-methylpropanamide IUPAC Name: (2S)-3-(4-aminophenoxy)-N-(4-cyano-3-iodanylphenyl)-2-hydroxy-2-methylpropanamide Traditional Name: (2S)-3-(4-aminophenoxy)-N-(4-cyano-3-iodanyl-phenyl)-2-hydroxy-2-methyl-propionamide Formula: C17H16IN3O3 MolecularWeight: 435.231864

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=C(C=C1)N)(C(=O)NC2=CC(=C(C=C2)C#N)I)O

Isomeric SMILES

C[C@](COC1=CC=C(C=C1)N)(C(=O)NC2=CC(=C(C=C2)C#N)[125I])O

InChI

InChI=1S/C17H16IN3O3/c1-17(23,10-24-14-6-3-12(20)4-7-14)16(22)21-13-5-2-11(9-19)15(18)8-13/h2-8,23H,10,20H2,1H3,(H,21,22)/t17-/m0/s1/i18-2