[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 5-[(2-chlorophenyl)sulfamoyl]-2-oxidanyl-benzoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 5-[(2-chlorophenyl)sulfamoyl]-2-oxidanyl-benzoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 5-[(2-chlorophenyl)sulfamoyl]-2-hydroxy-benzoate CAS Name: 5-[(2-chlorophenyl)sulfamoyl]-2-hydroxybenzoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 5-[(2-chlorophenyl)sulfamoyl]-2-hydroxybenzoate Traditional Name: 5-[(2-chlorophenyl)sulfamoyl]-2-hydroxy-benzoic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C25H27ClN2O6S MolecularWeight: 519.00968

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=C(C=CC(=C4)S(=O)(=O)NC5=CC=CC=C5Cl)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=C(C=CC(=C4)S(=O)(=O)NC5=CC=CC=C5Cl)O

InChI

InChI=1S/C25H27ClN2O6S/c26-20-3-1-2-4-21(20)28-35(32,33)18-5-6-22(29)19(10-18)24(31)34-14-23(30)27-25-11-15-7-16(12-25)9-17(8-15)13-25/h1-6,10,15-17,28-29H,7-9,11-14H2,(H,27,30)