3-[[3,4-bis(oxidanyl)phenyl]methylamino]-4-chloranyl-benzenesulfonamide

Systemtic Name: 3-[[3,4-bis(oxidanyl)phenyl]methylamino]-4-chloranyl-benzenesulfonamide Openeye Name: 4-chloro-3-[(3,4-dihydroxyphenyl)methylamino]benzenesulfonamide CAS Name: 4-chloro-3-[(3,4-dihydroxyphenyl)methylamino]benzenesulfonamide IUPAC Name: 4-chloro-3-[(3,4-dihydroxyphenyl)methylamino]benzenesulfonamide Traditional Name: 4-chloro-3-(protocatechuylamino)benzenesulfonamide Formula: C13H13ClN2O4S MolecularWeight: 328.77132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC2=C(C=CC(=C2)S(=O)(=O)N)Cl)O)O

Isomeric SMILES

C1=CC(=C(C=C1CNC2=C(C=CC(=C2)S(=O)(=O)N)Cl)O)O

InChI

InChI=1S/C13H13ClN2O4S/c14-10-3-2-9(21(15,19)20)6-11(10)16-7-8-1-4-12(17)13(18)5-8/h1-6,16-18H,7H2,(H2,15,19,20)