2-[2-(3-iodanyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]guanidine

Systemtic Name: 2-[2-(3-iodanyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]guanidine Openeye Name: 2-[2-hydroxy-2-(4-hydroxy-3-iodo-phenyl)ethyl]guanidine CAS Name: 2-[2-hydroxy-2-(4-hydroxy-3-iodophenyl)ethyl]guanidine IUPAC Name: 2-[2-hydroxy-2-(4-hydroxy-3-iodophenyl)ethyl]guanidine Traditional Name: 2-[2-hydroxy-2-(4-hydroxy-3-iodo-phenyl)ethyl]guanidine Formula: C9H12IN3O2 MolecularWeight: 319.116418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(CN=C(N)N)O)I)O

Isomeric SMILES

C1=CC(=C(C=C1[11CH]([11CH2]N=C(N)N)O)I)O

InChI

InChI=1S/C9H12IN3O2/c10-6-3-5(1-2-7(6)14)8(15)4-13-9(11)12/h1-3,8,14-15H,4H2,(H4,11,12,13)/i4-1,8-1