ethyl 4-[2-[[(5S,7S)-3-chloranyl-1-adamantyl]carbonyloxy]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[(5S,7S)-3-chloranyl-1-adamantyl]carbonyloxy]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(5S,7S)-3-chloroadamantane-1-carbonyl]oxyacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[(5S,7S)-3-chloro-1-adamantyl]-oxomethoxy]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(5S,7S)-3-chloroadamantane-1-carbonyl]oxyacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(5S,7S)-3-chloroadamantane-1-carbonyl]oxyacetyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H29ClN2O5 MolecularWeight: 412.90766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)COC(=O)C23C[C@@H]4C[C@@H](C2)CC(C4)(C3)Cl

InChI

InChI=1S/C20H29ClN2O5/c1-2-27-18(26)23-5-3-22(4-6-23)16(24)12-28-17(25)19-8-14-7-15(9-19)11-20(21,10-14)13-19/h14-15H,2-13H2,1H3/t14-,15-,19?,20?/m0/s1