(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 4-(dimethylsulfamoyl)benzoate

Systemtic Name: (5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 4-(dimethylsulfamoyl)benzoate Openeye Name: (5,5-dimethyl-3-oxo-cyclohexen-1-yl) 4-(dimethylsulfamoyl)benzoate CAS Name: 4-(dimethylsulfamoyl)benzoic acid (5,5-dimethyl-3-oxo-1-cyclohexenyl) ester IUPAC Name: (5,5-dimethyl-3-oxocyclohexen-1-yl) 4-(dimethylsulfamoyl)benzoate Traditional Name: 4-(dimethylsulfamoyl)benzoic acid (3-keto-5,5-dimethyl-cyclohexen-1-yl) ester Formula: C17H21NO5S MolecularWeight: 351.41734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5S/c1-17(2)10-13(19)9-14(11-17)23-16(20)12-5-7-15(8-6-12)24(21,22)18(3)4/h5-9H,10-11H2,1-4H3