[2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-(3-bromanyl-1-adamantyl)ethanoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-(3-bromanyl-1-adamantyl)ethanoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 2-(3-bromo-1-adamantyl)acetate CAS Name: 2-(3-bromo-1-adamantyl)acetic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 2-(3-bromo-1-adamantyl)acetate Traditional Name: 2-(3-bromo-1-adamantyl)acetic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C18H28BrNO3 MolecularWeight: 386.32382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC(=O)CC12CC3CC(C1)CC(C3)(C2)Br

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)CC12CC3CC(C1)CC(C3)(C2)Br

InChI

InChI=1S/C18H28BrNO3/c1-16(2,3)20-14(21)10-23-15(22)9-17-5-12-4-13(6-17)8-18(19,7-12)11-17/h12-13H,4-11H2,1-3H3,(H,20,21)