[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 4-[ethyl(phenyl)sulfamoyl]benzoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 4-[ethyl(phenyl)sulfamoyl]benzoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 4-[ethyl(phenyl)sulfamoyl]benzoate CAS Name: 4-[ethyl(phenyl)sulfamoyl]benzoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 4-[ethyl(phenyl)sulfamoyl]benzoate Traditional Name: 4-[ethyl(phenyl)sulfamoyl]benzoic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C27H32N2O5S MolecularWeight: 496.61838

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H32N2O5S/c1-2-29(23-6-4-3-5-7-23)35(32,33)24-10-8-22(9-11-24)26(31)34-18-25(30)28-27-15-19-12-20(16-27)14-21(13-19)17-27/h3-11,19-21H,2,12-18H2,1H3,(H,28,30)