tert-butyl 4-(1-adamantylamino)-2,3-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl 4-(1-adamantylamino)-2,3-dimethyl-4-oxidanylidene-butanoate Openeye Name: tert-butyl 4-(1-adamantylamino)-2,3-dimethyl-4-oxo-butanoate CAS Name: 4-(1-adamantylamino)-2,3-dimethyl-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-adamantylamino)-2,3-dimethyl-4-oxobutanoate Traditional Name: 4-(1-adamantylamino)-4-keto-2,3-dimethyl-butyric acid tert-butyl ester Formula: C20H33NO3 MolecularWeight: 335.48092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)C(=O)OC(C)(C)C)C(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C(C)C(=O)OC(C)(C)C)C(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C20H33NO3/c1-12(13(2)18(23)24-19(3,4)5)17(22)21-20-9-14-6-15(10-20)8-16(7-14)11-20/h12-16H,6-11H2,1-5H3,(H,21,22)