dimethyl 5-(4-phenylbutylsulfamoyl)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(4-phenylbutylsulfamoyl)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(4-phenylbutylsulfamoyl)benzene-1,3-dicarboxylate CAS Name: 5-(4-phenylbutylsulfamoyl)benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(4-phenylbutylsulfamoyl)benzene-1,3-dicarboxylate Traditional Name: 5-(4-phenylbutylsulfamoyl)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NCCCCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NCCCCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H23NO6S/c1-26-19(22)16-12-17(20(23)27-2)14-18(13-16)28(24,25)21-11-7-6-10-15-8-4-3-5-9-15/h3-5,8-9,12-14,21H,6-7,10-11H2,1-2H3