[2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 4-[methoxy(methyl)sulfamoyl]benzoate

Systemtic Name: [2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 4-[methoxy(methyl)sulfamoyl]benzoate Openeye Name: [2-(2,5-diethylphenyl)-2-oxo-ethyl] 4-[methoxy(methyl)sulfamoyl]benzoate CAS Name: 4-[methoxy(methyl)sulfamoyl]benzoic acid [2-(2,5-diethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-diethylphenyl)-2-oxoethyl] 4-[methoxy(methyl)sulfamoyl]benzoate Traditional Name: 4-[methoxy(methyl)sulfamoyl]benzoic acid [2-(2,5-diethylphenyl)-2-keto-ethyl] ester Formula: C21H25NO6S MolecularWeight: 419.4913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)OC

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)OC

InChI

InChI=1S/C21H25NO6S/c1-5-15-7-8-16(6-2)19(13-15)20(23)14-28-21(24)17-9-11-18(12-10-17)29(25,26)22(3)27-4/h7-13H,5-6,14H2,1-4H3