[2-[1-(4-ethylphenyl)ethylamino]-2-oxidanylidene-ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate

Systemtic Name: [2-[1-(4-ethylphenyl)ethylamino]-2-oxidanylidene-ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate Openeye Name: [2-[1-(4-ethylphenyl)ethylamino]-2-oxo-ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate CAS Name: 3,4-dimethyl-5-sulfamoylbenzoic acid [2-[1-(4-ethylphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-ethylphenyl)ethylamino]-2-oxoethyl] 3,4-dimethyl-5-sulfamoylbenzoate Traditional Name: 3,4-dimethyl-5-sulfamoyl-benzoic acid [2-[1-(4-ethylphenyl)ethylamino]-2-keto-ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5S/c1-5-16-6-8-17(9-7-16)15(4)23-20(24)12-28-21(25)18-10-13(2)14(3)19(11-18)29(22,26)27/h6-11,15H,5,12H2,1-4H3,(H,23,24)(H2,22,26,27)