(2-morpholin-4-yl-2-oxidanylidene-ethyl) 2-[(5S,7S)-3-bromanyl-1-adamantyl]ethanoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 2-[(5S,7S)-3-bromanyl-1-adamantyl]ethanoate Openeye Name: (2-morpholino-2-oxo-ethyl) 2-[(5S,7S)-3-bromo-1-adamantyl]acetate CAS Name: 2-[(5S,7S)-3-bromo-1-adamantyl]acetic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 2-[(5S,7S)-3-bromo-1-adamantyl]acetate Traditional Name: 2-[(5S,7S)-3-bromo-1-adamantyl]acetic acid (2-keto-2-morpholino-ethyl) ester Formula: C18H26BrNO4 MolecularWeight: 400.30734

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

C1COCCN1C(=O)COC(=O)CC23C[C@@H]4C[C@@H](C2)CC(C4)(C3)Br

InChI

InChI=1S/C18H26BrNO4/c19-18-8-13-5-14(9-18)7-17(6-13,12-18)10-16(22)24-11-15(21)20-1-3-23-4-2-20/h13-14H,1-12H2/t13-,14-,17?,18?/m0/s1