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(phenylmethyl) (2R,6S)-2-ethynyl-6-(phenylmethyl)piperidine-1-carboxylate

(phenylmethyl) (2R,6S)-2-ethynyl-6-(phenylmethyl)piperidine-1-carboxylate

Systemtic Name:(phenylmethyl) (2R,6S)-2-ethynyl-6-(phenylmethyl)piperidine-1-carboxylate
Openeye Name:benzyl (2S,6R)-2-benzyl-6-ethynyl-piperidine-1-carboxylate
CAS Name:(2R,6S)-2-ethynyl-6-(phenylmethyl)-1-piperidinecarboxylic acid (phenylmethyl) ester
IUPAC Name:benzyl (2S,6R)-2-benzyl-6-ethynylpiperidine-1-carboxylate
Traditional Name:(2S,6R)-2-benzyl-6-ethynyl-piperidine-1-carboxylic acid benzyl ester
Formula: C22H23NO2
MolecularWeight: 333.42352
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Descriptors Computed from Structure

Canonical SMILES:

C#CC1CCCC(N1C(=O)OCC2=CC=CC=C2)CC3=CC=CC=C3


Isomeric SMILES

C#C[C@H]1CCC[C@H](N1C(=O)OCC2=CC=CC=C2)CC3=CC=CC=C3


InChI

InChI=1S/C22H23NO2/c1-2-20-14-9-15-21(16-18-10-5-3-6-11-18)23(20)22(24)25-17-19-12-7-4-8-13-19/h1,3-8,10-13,20-21H,9,14-17H2/t20-,21-/m0/s1


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