[1-(tert-butylcarbamoyl)-2,2,4,4-tetramethyl-3-oxidanylidene-cyclobutyl] adamantane-1-carboxylate

Systemtic Name: [1-(tert-butylcarbamoyl)-2,2,4,4-tetramethyl-3-oxidanylidene-cyclobutyl] adamantane-1-carboxylate Openeye Name: [1-(tert-butylcarbamoyl)-2,2,4,4-tetramethyl-3-oxo-cyclobutyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [1-[(tert-butylamino)-oxomethyl]-2,2,4,4-tetramethyl-3-oxocyclobutyl] ester IUPAC Name: [1-(tert-butylcarbamoyl)-2,2,4,4-tetramethyl-3-oxocyclobutyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [1-(tert-butylcarbamoyl)-3-keto-2,2,4,4-tetramethyl-cyclobutyl] ester Formula: C24H37NO4 MolecularWeight: 403.55488

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(C1(C(=O)NC(C)(C)C)OC(=O)C23CC4CC(C2)CC(C4)C3)(C)C)C

Isomeric SMILES

CC1(C(=O)C(C1(C(=O)NC(C)(C)C)OC(=O)C23CC4CC(C2)CC(C4)C3)(C)C)C

InChI

InChI=1S/C24H37NO4/c1-20(2,3)25-18(27)24(21(4,5)17(26)22(24,6)7)29-19(28)23-11-14-8-15(12-23)10-16(9-14)13-23/h14-16H,8-13H2,1-7H3,(H,25,27)