N-[(2R,3S)-2,4-dimethyl-1-oxidanyl-pentan-3-yl]-N-[(4-methoxyphenyl)methyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2R,3S)-2,4-dimethyl-1-oxidanyl-pentan-3-yl]-N-[(4-methoxyphenyl)methyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S,2R)-3-hydroxy-1-isopropyl-2-methyl-propyl]-N-[(4-methoxyphenyl)methyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2R,3S)-1-hydroxy-2,4-dimethylpentan-3-yl]-N-[(4-methoxyphenyl)methyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2R,3S)-1-hydroxy-2,4-dimethylpentan-3-yl]-N-[(4-methoxyphenyl)methyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S,2R)-3-hydroxy-1-isopropyl-2-methyl-propyl]-4-methyl-N-p-anisyl-benzenesulfonamide Formula: C22H31NO4S MolecularWeight: 405.55084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)OC)C(C(C)C)C(C)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)OC)[C@H]([C@@H](C)CO)C(C)C

InChI

InChI=1S/C22H31NO4S/c1-16(2)22(18(4)15-24)23(14-19-8-10-20(27-5)11-9-19)28(25,26)21-12-6-17(3)7-13-21/h6-13,16,18,22,24H,14-15H2,1-5H3/t18-,22-/m0/s1