ethyl 1-[2-[(3-phenyl-1-adamantyl)carbonyloxy]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(3-phenyl-1-adamantyl)carbonyloxy]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(3-phenyladamantane-1-carbonyl)oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[oxo-(3-phenyl-1-adamantyl)methoxy]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-phenyladamantane-1-carbonyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-phenyladamantane-1-carbonyl)oxyacetyl]isonipecotic acid ethyl ester Formula: C27H35NO5 MolecularWeight: 453.5705

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=CC=C5

InChI

InChI=1S/C27H35NO5/c1-2-32-24(30)21-8-10-28(11-9-21)23(29)17-33-25(31)27-15-19-12-20(16-27)14-26(13-19,18-27)22-6-4-3-5-7-22/h3-7,19-21H,2,8-18H2,1H3