3-bromanylaniline; sulfuric acid

Systemtic Name: 3-bromanylaniline; sulfuric acid Openeye Name: 3-bromoaniline; sulfuric acid CAS Name: 3-bromoaniline; sulfuric acid IUPAC Name: 3-bromoaniline; sulfuric acid Traditional Name: (3-bromophenyl)amine; sulfuric acid Formula: C12H14Br2N2O4S MolecularWeight: 442.12356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)N.C1=CC(=CC(=C1)Br)N.OS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)N.C1=CC(=CC(=C1)Br)N.OS(=O)(=O)O

InChI

InChI=1S/2C6H6BrN.H2O4S/c2*7-5-2-1-3-6(8)4-5;1-5(2,3)4/h2*1-4H,8H2;(H2,1,2,3,4)