[2-(cyclohexylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-iodophenyl)sulfamoyl]benzoate

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-iodophenyl)sulfamoyl]benzoate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoate CAS Name: 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C21H22ClIN2O5S MolecularWeight: 576.83225

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)I)Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)I)Cl

InChI

InChI=1S/C21H22ClIN2O5S/c22-19-11-10-17(31(28,29)25-16-8-6-14(23)7-9-16)12-18(19)21(27)30-13-20(26)24-15-4-2-1-3-5-15/h6-12,15,25H,1-5,13H2,(H,24,26)