2,5-bis(chloranyl)aniline; [4-(sulfonylamino)phenyl]methanesulfonic acid

Systemtic Name: 2,5-bis(chloranyl)aniline; [4-(sulfonylamino)phenyl]methanesulfonic acid Openeye Name: 2,5-dichloroaniline; [4-(sulfonylamino)phenyl]methanesulfonic acid CAS Name: 2,5-dichloroaniline; [4-(sulfonylamino)phenyl]methanesulfonic acid IUPAC Name: 2,5-dichloroaniline; [4-(sulfonylamino)phenyl]methanesulfonic acid Traditional Name: (2,5-dichlorophenyl)amine; [4-(sulfonylamino)phenyl]methanesulfonic acid Formula: C13H12Cl2N2O5S2 MolecularWeight: 411.28078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)O)N=S(=O)=O.C1=CC(=C(C=C1Cl)N)Cl

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)O)N=S(=O)=O.C1=CC(=C(C=C1Cl)N)Cl

InChI

InChI=1S/C7H7NO5S2.C6H5Cl2N/c9-14(10)8-7-3-1-6(2-4-7)5-15(11,12)13;7-4-1-2-5(8)6(9)3-4/h1-4H,5H2,(H,11,12,13);1-3H,9H2