[1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-(1-adamantyl)ethanoate

Systemtic Name: [1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-(1-adamantyl)ethanoate Openeye Name: [1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 2-(1-adamantyl)acetate CAS Name: 2-(1-adamantyl)acetic acid [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 2-(1-adamantyl)acetate Traditional Name: 2-(1-adamantyl)acetic acid [2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H28N2O5S/c1-13(20(25)23-17-3-2-4-18(8-17)29(22,26)27)28-19(24)12-21-9-14-5-15(10-21)7-16(6-14)11-21/h2-4,8,13-16H,5-7,9-12H2,1H3,(H,23,25)(H2,22,26,27)