2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]guanidine; sulfuric acid

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]guanidine; sulfuric acid Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl]guanidine; sulfuric acid CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl]guanidine; sulfuric acid IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl]guanidine; sulfuric acid Traditional Name: 2-(2-chloro-6-fluoro-benzyl)guanidine; sulfuric acid Formula: C16H20Cl2F2N6O4S MolecularWeight: 501.335606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN=C(N)N)F.C1=CC(=C(C(=C1)Cl)CN=C(N)N)F.OS(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN=C(N)N)F.C1=CC(=C(C(=C1)Cl)CN=C(N)N)F.OS(=O)(=O)O

InChI

InChI=1S/2C8H9ClFN3.H2O4S/c2*9-6-2-1-3-7(10)5(6)4-13-8(11)12;1-5(2,3)4/h2*1-3H,4H2,(H4,11,12,13);(H2,1,2,3,4)