2-[2-(disulfoamino)-3-oxidanylidene-propyl]-5-oxidanyl-benzenesulfonic acid

Systemtic Name: 2-[2-(disulfoamino)-3-oxidanylidene-propyl]-5-oxidanyl-benzenesulfonic acid Openeye Name: 2-[2-(disulfoamino)-3-oxo-propyl]-5-hydroxy-benzenesulfonic acid CAS Name: 2-[2-(disulfoamino)-3-oxopropyl]-5-hydroxybenzenesulfonic acid IUPAC Name: 2-[2-(disulfoamino)-3-oxopropyl]-5-hydroxybenzenesulfonic acid Traditional Name: 2-[2-(disulfoamino)-3-keto-propyl]-5-hydroxy-besylic acid Formula: C9H11NO11S3 MolecularWeight: 405.37874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)S(=O)(=O)O)CC(C=O)N(S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1O)S(=O)(=O)O)CC(C=O)N(S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C9H11NO11S3/c11-5-7(10(23(16,17)18)24(19,20)21)3-6-1-2-8(12)4-9(6)22(13,14)15/h1-2,4-5,7,12H,3H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)