[2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] adamantane-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] adamantane-2-carboxylate Openeye Name: [2-oxo-2-(1,1,3,3-tetramethylbutylamino)ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-keto-2-(1,1,3,3-tetramethylbutylamino)ethyl] ester Formula: C21H35NO3 MolecularWeight: 349.5075

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=O)COC(=O)C1C2CC3CC(C2)CC1C3

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=O)COC(=O)C1C2CC3CC(C2)CC1C3

InChI

InChI=1S/C21H35NO3/c1-20(2,3)12-21(4,5)22-17(23)11-25-19(24)18-15-7-13-6-14(9-15)10-16(18)8-13/h13-16,18H,6-12H2,1-5H3,(H,22,23)