[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-fluorophenyl)sulfamoyl]benzoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-fluorophenyl)sulfamoyl]benzoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzoate CAS Name: 2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C25H25ClFNO5S MolecularWeight: 505.986103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25ClFNO5S/c26-22-6-5-20(34(31,32)28-19-3-1-18(27)2-4-19)10-21(22)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