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

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-oxidanyl-5-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 5-(benzylsulfamoyl)-2-hydroxy-benzoate CAS Name: 2-hydroxy-5-[(phenylmethyl)sulfamoyl]benzoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 5-(benzylsulfamoyl)-2-hydroxybenzoate Traditional Name: 5-(benzylsulfamoyl)-2-hydroxy-benzoic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C26H30N2O6S MolecularWeight: 498.5912

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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)NCC5=CC=CC=C5)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=C(C=CC(=C4)S(=O)(=O)NCC5=CC=CC=C5)O

InChI

InChI=1S/C26H30N2O6S/c29-23-7-6-21(35(32,33)27-15-17-4-2-1-3-5-17)11-22(23)25(31)34-16-24(30)28-26-12-18-8-19(13-26)10-20(9-18)14-26/h1-7,11,18-20,27,29H,8-10,12-16H2,(H,28,30)