[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenoxyethylamino)ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate Openeye Name: [2-oxo-2-(2-phenoxyethylamino)ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate CAS Name: 3,4-dimethyl-5-sulfamoylbenzoic acid [2-oxo-2-(2-phenoxyethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenoxyethylamino)ethyl] 3,4-dimethyl-5-sulfamoylbenzoate Traditional Name: 3,4-dimethyl-5-sulfamoyl-benzoic acid [2-keto-2-(2-phenoxyethylamino)ethyl] ester Formula: C19H22N2O6S MolecularWeight: 406.45278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)OCC(=O)NCCOC2=CC=CC=C2)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)OCC(=O)NCCOC2=CC=CC=C2)S(=O)(=O)N)C

InChI

InChI=1S/C19H22N2O6S/c1-13-10-15(11-17(14(13)2)28(20,24)25)19(23)27-12-18(22)21-8-9-26-16-6-4-3-5-7-16/h3-7,10-11H,8-9,12H2,1-2H3,(H,21,22)(H2,20,24,25)