N-[(1S,2S,3R)-2-iodanyl-3,4-bis(oxidanyl)-1-phenyl-butyl]benzamide

Systemtic Name: N-[(1S,2S,3R)-2-iodanyl-3,4-bis(oxidanyl)-1-phenyl-butyl]benzamide Openeye Name: N-[(1S,2S,3R)-3,4-dihydroxy-2-iodo-1-phenyl-butyl]benzamide CAS Name: N-[(1S,2S,3R)-3,4-dihydroxy-2-iodo-1-phenylbutyl]benzamide IUPAC Name: N-[(1S,2S,3R)-3,4-dihydroxy-2-iodo-1-phenylbutyl]benzamide Traditional Name: N-[(1S,2S,3R)-3,4-dihydroxy-2-iodo-1-phenyl-butyl]benzamide Formula: C17H18INO3 MolecularWeight: 411.23419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(CO)O)I)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]([C@@H]([C@@H](CO)O)I)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H18INO3/c18-15(14(21)11-20)16(12-7-3-1-4-8-12)19-17(22)13-9-5-2-6-10-13/h1-10,14-16,20-21H,11H2,(H,19,22)/t14-,15-,16+/m1/s1