[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl] 3-[(4-iodophenyl)sulfamoyl]benzoate

Systemtic Name: [2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl] 3-[(4-iodophenyl)sulfamoyl]benzoate Openeye Name: [2-[cyclohexyl(methyl)amino]-2-oxo-ethyl] 3-[(4-iodophenyl)sulfamoyl]benzoate CAS Name: 3-[(4-iodophenyl)sulfamoyl]benzoic acid [2-[cyclohexyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexyl(methyl)amino]-2-oxoethyl] 3-[(4-iodophenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-iodophenyl)sulfamoyl]benzoic acid [2-[cyclohexyl(methyl)amino]-2-keto-ethyl] ester Formula: C22H25IN2O5S MolecularWeight: 556.41377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

CN(C1CCCCC1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C22H25IN2O5S/c1-25(19-7-3-2-4-8-19)21(26)15-30-22(27)16-6-5-9-20(14-16)31(28,29)24-18-12-10-17(23)11-13-18/h5-6,9-14,19,24H,2-4,7-8,15H2,1H3