[2-(1-adamantyl)-2-oxidanylidene-ethyl] 3-(propan-2-ylsulfamoyl)benzoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 3-(propan-2-ylsulfamoyl)benzoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 3-(isopropylsulfamoyl)benzoate CAS Name: 3-(propan-2-ylsulfamoyl)benzoic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 3-(propan-2-ylsulfamoyl)benzoate Traditional Name: 3-(isopropylsulfamoyl)benzoic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H29NO5S/c1-14(2)23-29(26,27)19-5-3-4-18(9-19)21(25)28-13-20(24)22-10-15-6-16(11-22)8-17(7-15)12-22/h3-5,9,14-17,23H,6-8,10-13H2,1-2H3