N-[4-[2-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]ethyl]phenyl]-4-iodanyl-benzenesulfonamide

Systemtic Name: N-[4-[2-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]ethyl]phenyl]-4-iodanyl-benzenesulfonamide Openeye Name: N-[4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]ethyl]phenyl]-4-iodo-benzenesulfonamide CAS Name: N-[4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]ethyl]phenyl]-4-iodobenzenesulfonamide IUPAC Name: N-[4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]ethyl]phenyl]-4-iodobenzenesulfonamide Traditional Name: N-[4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]ethyl]phenyl]-4-iodo-benzenesulfonamide Formula: C22H23IN2O4S MolecularWeight: 538.39849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNCC(C2=CC=C(C=C2)O)O)NS(=O)(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1=CC(=CC=C1CCNCC(C2=CC=C(C=C2)O)O)NS(=O)(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C22H23IN2O4S/c23-18-5-11-21(12-6-18)30(28,29)25-19-7-1-16(2-8-19)13-14-24-15-22(27)17-3-9-20(26)10-4-17/h1-12,22,24-27H,13-15H2