methyl 1-[2-[[3-(4-methoxyphenyl)-1-adamantyl]carbonyloxy]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[[3-(4-methoxyphenyl)-1-adamantyl]carbonyloxy]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[3-(4-methoxyphenyl)adamantane-1-carbonyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[3-(4-methoxyphenyl)-1-adamantyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[3-(4-methoxyphenyl)adamantane-1-carbonyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[3-(4-methoxyphenyl)adamantane-1-carbonyl]oxyacetyl]isonipecotic acid methyl ester Formula: C27H35NO6 MolecularWeight: 469.5699

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)OCC(=O)N5CCC(CC5)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)OCC(=O)N5CCC(CC5)C(=O)OC

InChI

InChI=1S/C27H35NO6/c1-32-22-5-3-21(4-6-22)26-12-18-11-19(13-26)15-27(14-18,17-26)25(31)34-16-23(29)28-9-7-20(8-10-28)24(30)33-2/h3-6,18-20H,7-17H2,1-2H3