N-[1,3-bis-(4-methylphenyl)sulfonyl-1-oxidanyl-propyl]methanamide

Systemtic Name: N-[1,3-bis-(4-methylphenyl)sulfonyl-1-oxidanyl-propyl]methanamide Openeye Name: N-[1-hydroxy-1,3-bis(p-tolylsulfonyl)propyl]formamide CAS Name: N-[1-hydroxy-1,3-bis-(4-methylphenyl)sulfonylpropyl]formamide IUPAC Name: N-[1-hydroxy-1,3-bis-(4-methylphenyl)sulfonylpropyl]formamide Traditional Name: N-(1-hydroxy-1,3-ditosyl-propyl)formamide Formula: C18H21NO6S2 MolecularWeight: 411.49244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(NC=O)(O)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(NC=O)(O)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H21NO6S2/c1-14-3-7-16(8-4-14)26(22,23)12-11-18(21,19-13-20)27(24,25)17-9-5-15(2)6-10-17/h3-10,13,21H,11-12H2,1-2H3,(H,19,20)