4-azido-N-[4-(2-iodanylethanoylamino)butyl]-2-oxidanyl-benzamide

Systemtic Name: 4-azido-N-[4-(2-iodanylethanoylamino)butyl]-2-oxidanyl-benzamide Openeye Name: 4-azido-2-hydroxy-N-[4-[(2-iodoacetyl)amino]butyl]benzamide CAS Name: 4-azido-2-hydroxy-N-[4-[(2-iodo-1-oxoethyl)amino]butyl]benzamide IUPAC Name: 4-azido-2-hydroxy-N-[4-[(2-iodoacetyl)amino]butyl]benzamide Traditional Name: 4-azido-2-hydroxy-N-[4-[(2-iodoacetyl)amino]butyl]benzamide Formula: C13H16IN5O3 MolecularWeight: 417.20231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=[N+]=[N-])O)C(=O)NCCCCNC(=O)CI

Isomeric SMILES

C1=CC(=C(C=C1N=[N+]=[N-])O)C(=O)NCCCCNC(=O)CI

InChI

InChI=1S/C13H16IN5O3/c14-8-12(21)16-5-1-2-6-17-13(22)10-4-3-9(18-19-15)7-11(10)20/h3-4,7,20H,1-2,5-6,8H2,(H,16,21)(H,17,22)