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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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