4-azanyl-N-[2,3-bis(chloranyl)-4,6-disulfamoyl-phenyl]butanamide

Systemtic Name: 4-azanyl-N-[2,3-bis(chloranyl)-4,6-disulfamoyl-phenyl]butanamide Openeye Name: 4-amino-N-(2,3-dichloro-4,6-disulfamoyl-phenyl)butanamide CAS Name: 4-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)butanamide IUPAC Name: 4-amino-N-(2,3-dichloro-4,6-disulfamoylphenyl)butanamide Traditional Name: 4-amino-N-(2,3-dichloro-4,6-disulfamoyl-phenyl)butyramide Formula: C10H14Cl2N4O5S2 MolecularWeight: 405.27796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1S(=O)(=O)N)Cl)Cl)NC(=O)CCCN)S(=O)(=O)N

Isomeric SMILES

C1=C(C(=C(C(=C1S(=O)(=O)N)Cl)Cl)NC(=O)CCCN)S(=O)(=O)N

InChI

InChI=1S/C10H14Cl2N4O5S2/c11-8-5(22(14,18)19)4-6(23(15,20)21)10(9(8)12)16-7(17)2-1-3-13/h4H,1-3,13H2,(H,16,17)(H2,14,18,19)(H2,15,20,21)