2-(4-sulfamoylphenoxy)ethyl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: 2-(4-sulfamoylphenoxy)ethyl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: 2-(4-sulfamoylphenoxy)ethyl 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid 2-(4-sulfamoylphenoxy)ethyl ester IUPAC Name: 2-(4-sulfamoylphenoxy)ethyl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid 2-(4-sulfamoylphenoxy)ethyl ester Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCCOC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCCOC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H31N3O6S/c23-32(28,29)19-3-1-18(2-4-19)30-7-8-31-20(26)5-6-24-21(27)25-22-12-15-9-16(13-22)11-17(10-15)14-22/h1-4,15-17H,5-14H2,(H2,23,28,29)(H2,24,25,27)