5-azanyl-N-methyl-N-octadecyl-2-oxidanyl-benzenesulfonamide

Systemtic Name: 5-azanyl-N-methyl-N-octadecyl-2-oxidanyl-benzenesulfonamide Openeye Name: 5-amino-2-hydroxy-N-methyl-N-octadecyl-benzenesulfonamide CAS Name: 5-amino-2-hydroxy-N-methyl-N-octadecylbenzenesulfonamide IUPAC Name: 5-amino-2-hydroxy-N-methyl-N-octadecylbenzenesulfonamide Traditional Name: 5-amino-2-hydroxy-N-methyl-N-stearyl-benzenesulfonamide Formula: C25H46N2O3S MolecularWeight: 454.70934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H46N2O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-27(2)31(29,30)25-22-23(26)19-20-24(25)28/h19-20,22,28H,3-18,21,26H2,1-2H3