[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-5-phenyl-1,3,4-oxadiazol-3-yl)ethanoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-5-phenyl-1,3,4-oxadiazol-3-yl)ethanoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetate CAS Name: 2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetate Traditional Name: 2-(2-keto-5-phenyl-1,3,4-oxadiazol-3-yl)acetic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)CN4C(=O)OC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)CN4C(=O)OC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C22H25N3O5/c26-18(23-22-9-14-6-15(10-22)8-16(7-14)11-22)13-29-19(27)12-25-21(28)30-20(24-25)17-4-2-1-3-5-17/h1-5,14-16H,6-13H2,(H,23,26)