N-[4-[(2S)-3-(methylamino)-2-oxidanyl-propyl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[(2S)-3-(methylamino)-2-oxidanyl-propyl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[(2S)-2-hydroxy-3-(methylamino)propyl]sulfonylphenyl]acetamide CAS Name: N-[4-[(2S)-2-hydroxy-3-(methylamino)propyl]sulfonylphenyl]acetamide IUPAC Name: N-[4-[(2S)-2-hydroxy-3-(methylamino)propyl]sulfonylphenyl]acetamide Traditional Name: N-[4-[(2S)-2-hydroxy-3-(methylamino)propyl]sulfonylphenyl]acetamide Formula: C12H18N2O4S MolecularWeight: 286.34732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CC(CNC)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)C[C@H](CNC)O

InChI

InChI=1S/C12H18N2O4S/c1-9(15)14-10-3-5-12(6-4-10)19(17,18)8-11(16)7-13-2/h3-6,11,13,16H,7-8H2,1-2H3,(H,14,15)/t11-/m0/s1