[2-(1-adamantyl)-2-oxidanylidene-ethyl] 4-chloranyl-3-[(4-chlorophenyl)sulfamoyl]benzoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 4-chloranyl-3-[(4-chlorophenyl)sulfamoyl]benzoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 4-chloro-3-[(4-chlorophenyl)sulfamoyl]benzoate CAS Name: 4-chloro-3-[(4-chlorophenyl)sulfamoyl]benzoic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 4-chloro-3-[(4-chlorophenyl)sulfamoyl]benzoate Traditional Name: 4-chloro-3-[(4-chlorophenyl)sulfamoyl]benzoic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C25H25Cl2NO5S MolecularWeight: 522.4407

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)C4=CC(=C(C=C4)Cl)S(=O)(=O)NC5=CC=C(C=C5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)C4=CC(=C(C=C4)Cl)S(=O)(=O)NC5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H25Cl2NO5S/c26-19-2-4-20(5-3-19)28-34(31,32)22-10-18(1-6-21(22)27)24(30)33-14-23(29)25-11-15-7-16(12-25)9-17(8-15)13-25/h1-6,10,15-17,28H,7-9,11-14H2