[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] 2-(phenylsulfonylamino)ethanoate

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] 2-(phenylsulfonylamino)ethanoate Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl] 2-(benzenesulfonamido)acetate CAS Name: 2-(benzenesulfonamido)acetic acid [2-(1-adamantylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl] 2-(benzenesulfonamido)acetate Traditional Name: 2-(benzenesulfonamido)acetic acid [2-(1-adamantylmethylamino)-2-keto-ethyl] ester Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)COC(=O)CNS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)COC(=O)CNS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H28N2O5S/c24-19(22-14-21-9-15-6-16(10-21)8-17(7-15)11-21)13-28-20(25)12-23-29(26,27)18-4-2-1-3-5-18/h1-5,15-17,23H,6-14H2,(H,22,24)