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

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-iodophenyl)sulfamoyl]benzoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoate CAS Name: 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C22H24ClIN2O5S MolecularWeight: 590.85883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)I)Cl

Isomeric SMILES

C1CCCC(CC1)NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)I)Cl

InChI

InChI=1S/C22H24ClIN2O5S/c23-20-12-11-18(32(29,30)26-17-9-7-15(24)8-10-17)13-19(20)22(28)31-14-21(27)25-16-5-3-1-2-4-6-16/h7-13,16,26H,1-6,14H2,(H,25,27)