N-[5-chloranyl-2-oxidanyl-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[5-chloranyl-2-oxidanyl-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[5-chloro-2-hydroxy-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[5-chloro-2-hydroxy-4-[[1-oxo-2-(3-pentadecylphenyl)sulfonylbutyl]amino]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[5-chloro-2-hydroxy-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[5-chloro-2-hydroxy-4-[2-(3-pentadecylphenyl)sulfonylbutanoylamino]phenyl]-2,2-dimethyl-propionamide Formula: C36H55ClN2O5S MolecularWeight: 663.3503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)C(CC)C(=O)NC2=CC(=C(C=C2Cl)NC(=O)C(C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)C(CC)C(=O)NC2=CC(=C(C=C2Cl)NC(=O)C(C)(C)C)O

InChI

InChI=1S/C36H55ClN2O5S/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-21-27-22-20-23-28(24-27)45(43,44)33(7-2)34(41)38-30-26-32(40)31(25-29(30)37)39-35(42)36(3,4)5/h20,22-26,33,40H,6-19,21H2,1-5H3,(H,38,41)(H,39,42)