(phenylmethyl) (3R,4R)-3-[1-adamantyl(azanyl)methyl]-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (3R,4R)-3-[1-adamantyl(azanyl)methyl]-4-oxidanyl-piperidine-1-carboxylate Openeye Name: benzyl (3R,4R)-3-[1-adamantyl(amino)methyl]-4-hydroxy-piperidine-1-carboxylate CAS Name: (3R,4R)-3-[1-adamantyl(amino)methyl]-4-hydroxy-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3R,4R)-3-[1-adamantyl(amino)methyl]-4-hydroxypiperidine-1-carboxylate Traditional Name: (3R,4R)-3-[1-adamantyl(amino)methyl]-4-hydroxy-piperidine-1-carboxylic acid benzyl ester Formula: C24H34N2O3 MolecularWeight: 398.53836

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1O)C(C23CC4CC(C2)CC(C4)C3)N)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(C[C@@H]([C@@H]1O)C(C23CC4CC(C2)CC(C4)C3)N)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C24H34N2O3/c25-22(24-11-17-8-18(12-24)10-19(9-17)13-24)20-14-26(7-6-21(20)27)23(28)29-15-16-4-2-1-3-5-16/h1-5,17-22,27H,6-15,25H2/t17?,18?,19?,20-,21+,22?,24?/m0/s1