5-[[3,4-bis(oxidanyl)phenyl]methylamino]-2-methyl-benzenesulfonamide

Systemtic Name: 5-[[3,4-bis(oxidanyl)phenyl]methylamino]-2-methyl-benzenesulfonamide Openeye Name: 5-[(3,4-dihydroxyphenyl)methylamino]-2-methyl-benzenesulfonamide CAS Name: 5-[(3,4-dihydroxyphenyl)methylamino]-2-methylbenzenesulfonamide IUPAC Name: 5-[(3,4-dihydroxyphenyl)methylamino]-2-methylbenzenesulfonamide Traditional Name: 2-methyl-5-(protocatechuylamino)benzenesulfonamide Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)O)O)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)O)O)S(=O)(=O)N

InChI

InChI=1S/C14H16N2O4S/c1-9-2-4-11(7-14(9)21(15,19)20)16-8-10-3-5-12(17)13(18)6-10/h2-7,16-18H,8H2,1H3,(H2,15,19,20)