N-[(3S,4R,5R)-4-ethenyl-2,7-dimethyl-5-oxidanyl-octan-3-yl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[(3S,4R,5R)-4-ethenyl-2,7-dimethyl-5-oxidanyl-octan-3-yl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[(1S,2R,3R)-3-hydroxy-1-isopropyl-5-methyl-2-vinyl-hexyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[(3S,4R,5R)-4-ethenyl-5-hydroxy-2,7-dimethyloctan-3-yl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[(3S,4R,5R)-4-ethenyl-5-hydroxy-2,7-dimethyloctan-3-yl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[(1S,2R)-2-[(1R)-1-hydroxy-3-methyl-butyl]-1-isopropyl-but-3-enyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C21H35NO3S MolecularWeight: 381.5725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N[C@H]([C@@H](C=C)[C@@H](CC(C)C)O)C(C)C)C

InChI

InChI=1S/C21H35NO3S/c1-9-18(19(23)10-13(2)3)20(14(4)5)22-26(24,25)21-16(7)11-15(6)12-17(21)8/h9,11-14,18-20,22-23H,1,10H2,2-8H3/t18-,19+,20-/m0/s1