ethyl 1-[3-(1-adamantyloxy)-2-oxidanyl-propyl]piperidine-3-carboxylate hydrochloride

Systemtic Name: ethyl 1-[3-(1-adamantyloxy)-2-oxidanyl-propyl]piperidine-3-carboxylate hydrochloride Openeye Name: ethyl 1-[3-(1-adamantyloxy)-2-hydroxy-propyl]piperidine-3-carboxylate hydrochloride CAS Name: 1-[3-(1-adamantyloxy)-2-hydroxypropyl]-3-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-[3-(1-adamantyloxy)-2-hydroxypropyl]piperidine-3-carboxylate hydrochloride Traditional Name: 1-[3-(1-adamantyloxy)-2-hydroxy-propyl]nipecotic acid ethyl ester hydrochloride Formula: C21H36ClNO4 MolecularWeight: 401.96784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(COC23CC4CC(C2)CC(C4)C3)O.Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC(COC23CC4CC(C2)CC(C4)C3)O.Cl

InChI

InChI=1S/C21H35NO4.ClH/c1-2-25-20(24)18-4-3-5-22(12-18)13-19(23)14-26-21-9-15-6-16(10-21)8-17(7-15)11-21;/h15-19,23H,2-14H2,1H3;1H