[2-[4-[(2R)-butan-2-yl]phenyl]-2-oxidanylidene-ethyl] 3-(dimethylsulfamoyl)benzoate

Systemtic Name: [2-[4-[(2R)-butan-2-yl]phenyl]-2-oxidanylidene-ethyl] 3-(dimethylsulfamoyl)benzoate Openeye Name: [2-[4-[(1R)-1-methylpropyl]phenyl]-2-oxo-ethyl] 3-(dimethylsulfamoyl)benzoate CAS Name: 3-(dimethylsulfamoyl)benzoic acid [2-[4-[(2R)-butan-2-yl]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[(2R)-butan-2-yl]phenyl]-2-oxoethyl] 3-(dimethylsulfamoyl)benzoate Traditional Name: 3-(dimethylsulfamoyl)benzoic acid [2-keto-2-[4-[(1R)-1-methylpropyl]phenyl]ethyl] ester Formula: C21H25NO5S MolecularWeight: 403.4919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C

Isomeric SMILES

CC[C@@H](C)C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H25NO5S/c1-5-15(2)16-9-11-17(12-10-16)20(23)14-27-21(24)18-7-6-8-19(13-18)28(25,26)22(3)4/h6-13,15H,5,14H2,1-4H3/t15-/m1/s1