2-[(3-iodanylphenyl)methyl]guanidine; 2-[(3-iodanylphenyl)methyl]guanidine; sulfuric acid

Systemtic Name: 2-[(3-iodanylphenyl)methyl]guanidine; 2-[(3-iodanylphenyl)methyl]guanidine; sulfuric acid Openeye Name: 2-[(3-iodanylphenyl)methyl]guanidine; 2-[(3-iodophenyl)methyl]guanidine; sulfuric acid CAS Name: 2-[(3-iodanylphenyl)methyl]guanidine; 2-[(3-iodophenyl)methyl]guanidine; sulfuric acid IUPAC Name: 2-[(3-iodanylphenyl)methyl]guanidine; 2-[(3-iodophenyl)methyl]guanidine; sulfuric acid Traditional Name: 2-(3-iodanylbenzyl)guanidine; 2-(3-iodobenzyl)guanidine; sulfuric acid Formula: C16H22I2N6O4S MolecularWeight: 652.259274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)CN=C(N)N.C1=CC(=CC(=C1)I)CN=C(N)N.OS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)I)CN=C(N)N.C1=CC(=CC(=C1)[131I])CN=C(N)N.OS(=O)(=O)O

InChI

InChI=1S/2C8H10IN3.H2O4S/c2*9-7-3-1-2-6(4-7)5-12-8(10)11;1-5(2,3)4/h2*1-4H,5H2,(H4,10,11,12);(H2,1,2,3,4)/i9+4;;