[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] 2-[(5S,7S)-3-bromanyl-1-adamantyl]ethanoate

Systemtic Name: [2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] 2-[(5S,7S)-3-bromanyl-1-adamantyl]ethanoate Openeye Name: [2-(2-methoxyethylamino)-2-oxo-ethyl] 2-[(5S,7S)-3-bromo-1-adamantyl]acetate CAS Name: 2-[(5S,7S)-3-bromo-1-adamantyl]acetic acid [2-(2-methoxyethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylamino)-2-oxoethyl] 2-[(5S,7S)-3-bromo-1-adamantyl]acetate Traditional Name: 2-[(5S,7S)-3-bromo-1-adamantyl]acetic acid [2-keto-2-(2-methoxyethylamino)ethyl] ester Formula: C17H26BrNO4 MolecularWeight: 388.29664

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)COC(=O)CC12CC3CC(C1)CC(C3)(C2)Br

Isomeric SMILES

COCCNC(=O)COC(=O)CC12C[C@@H]3C[C@@H](C1)CC(C3)(C2)Br

InChI

InChI=1S/C17H26BrNO4/c1-22-3-2-19-14(20)10-23-15(21)9-16-5-12-4-13(6-16)8-17(18,7-12)11-16/h12-13H,2-11H2,1H3,(H,19,20)/t12-,13-,16?,17?/m0/s1