2,4,6-trimethyl-N-[(3S,4R)-2-methyl-4-oxidanyl-hex-5-yn-3-yl]benzenesulfonamide

Systemtic Name: 2,4,6-trimethyl-N-[(3S,4R)-2-methyl-4-oxidanyl-hex-5-yn-3-yl]benzenesulfonamide Openeye Name: N-[(1S,2R)-2-hydroxy-1-isopropyl-but-3-ynyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[(3S,4R)-4-hydroxy-2-methylhex-5-yn-3-yl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[(3S,4R)-4-hydroxy-2-methylhex-5-yn-3-yl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[(1S,2R)-2-hydroxy-1-isopropyl-but-3-ynyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C16H23NO3S MolecularWeight: 309.42372

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)O)C

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3S/c1-7-14(18)15(10(2)3)17-21(19,20)16-12(5)8-11(4)9-13(16)6/h1,8-10,14-15,17-18H,2-6H3/t14-,15+/m1/s1